3-(azepan-1-yl)-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(azepan-1-yl)-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-(azepan-1-yl)-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-(1-azepanyl)-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-(azepan-1-yl)-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-(azepan-1-yl)-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCN2CCCCCC2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCN2CCCCCC2

InChI

InChI=1S/C16H23N3O3/c1-13-14(7-6-8-15(13)19(21)22)17-16(20)9-12-18-10-4-2-3-5-11-18/h6-8H,2-5,9-12H2,1H3,(H,17,20)