nimodipine
3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C21H26N2O7 |
|---|---|
| Molecular Weight | 418.4 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 120.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 418.174 |
| Heavy Atoms | 30 |
| Complexity | 736.0 |
Chemical Identifiers
| CAS Number | 66085-59-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC |
| InChIKey | UIAGMCDKSXEBJQ-UHFFFAOYSA-N |
📖 Product Overview
nimodipine (CAS: 66085-59-4) is a chemical compound with molecular formula C21H26N2O7 and molecular weight 418.4 g/mol. Its IUPAC systematic name is 3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
UIAGMCDKSXEBJQ-UHFFFAOYSA-N.
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC.
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