VUFB 10,052
benzyl-[2-(1,2,3,5,6,7-hexahydro-s-indacen-1-ylamino)-2-oxoethyl]-propan-2-ylazanium chloride
| Molecular Formula | C24H31ClN2O |
|---|---|
| Molecular Weight | 399.0 g/mol |
| Topological Polar Surface Area | 33.5 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.2125 |
| Heavy Atoms | 28 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 75463-40-0 |
|---|---|
| SMILES | CC(C)[NH+](CC1=CC=CC=C1)CC(=O)NC2CCC3=C2C=C4CCCC4=C3.[Cl-] |
| InChIKey | NHWXXPACCQHAPE-UHFFFAOYSA-N |
📖 Product Overview
VUFB 10,052 (CAS: 75463-40-0) is a chemical compound with molecular formula C24H31ClN2O and molecular weight 399.0 g/mol. Its IUPAC systematic name is benzyl-[2-(1,2,3,5,6,7-hexahydro-s-indacen-1-ylamino)-2-oxoethyl]-propan-2-ylazanium chloride.
NHWXXPACCQHAPE-UHFFFAOYSA-N.
SMILES: CC(C)[NH+](CC1=CC=CC=C1)CC(=O)NC2CCC3=C2C=C4CCCC4=C3.[Cl-].
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