2-(azepan-1-yl)-N-(4-nitrophenyl)propanamide

Systemtic Name: 2-(azepan-1-yl)-N-(4-nitrophenyl)propanamide Openeye Name: 2-(azepan-1-yl)-N-(4-nitrophenyl)propanamide CAS Name: 2-(1-azepanyl)-N-(4-nitrophenyl)propanamide IUPAC Name: 2-(azepan-1-yl)-N-(4-nitrophenyl)propanamide Traditional Name: 2-(azepan-1-yl)-N-(4-nitrophenyl)propionamide Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCCCCC2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCCCCC2

InChI

InChI=1S/C15H21N3O3/c1-12(17-10-4-2-3-5-11-17)15(19)16-13-6-8-14(9-7-13)18(20)21/h6-9,12H,2-5,10-11H2,1H3,(H,16,19)