3-(1,3-benzodioxol-5-yl)-N-(2-oxidanylideneazepan-3-yl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(2-oxidanylideneazepan-3-yl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(2-oxoazepan-3-yl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(2-oxo-3-azepanyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(2-oxoazepan-3-yl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(2-ketoazepan-3-yl)propionamide Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N2O4/c19-15(18-12-3-1-2-8-17-16(12)20)7-5-11-4-6-13-14(9-11)22-10-21-13/h4,6,9,12H,1-3,5,7-8,10H2,(H,17,20)(H,18,19)