ChemDiv1_000559
1-(2-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Also Known As: ChemDiv1_000559|HMS588J09|BAS 00016297|SR-01000399956-1|(3S)-1-(2-NITROPHENYL)-2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLIC ACID|1-(2-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid|1-(2-nitrophenyl)-1,2,3,4-tetrahydrobeta-carboline-3-carboxylic acid|1-(2-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid|1-(2-Nitro-phenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
| Molecular Formula | C18H15N3O4 |
|---|---|
| Molecular Weight | 337.10626 g/mol |
| LogP | 2.7644 |
| Topological Polar Surface Area | 108.26 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.10626 |
| Monoisotopic Mass | 337.10626 |
| Heavy Atoms | 25 |
| Complexity | 994.9048 |
Chemical Identifiers
| CAS Number | 353263-78-2 |
|---|---|
| SMILES | C1C(NC(C2=C1C3=CC=CC=C3N2)C4=CC=CC=C4[N+](=O)[O-])C(=O)O |
Product Overview
ChemDiv1_000559 (CAS 353263-78-2), with molecular formula C18H15N3O4 and molecular weight 337.10626 g/mol. IUPAC: 1-(2-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid.
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