N-[2-(azepan-1-yl)-5-nitro-phenyl]-2-chloranyl-ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-nitro-phenyl]-2-chloranyl-ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-nitro-phenyl]-2-chloro-acetamide CAS Name: N-[2-(1-azepanyl)-5-nitrophenyl]-2-chloroacetamide IUPAC Name: N-[2-(azepan-1-yl)-5-nitrophenyl]-2-chloroacetamide Traditional Name: N-[2-(azepan-1-yl)-5-nitro-phenyl]-2-chloro-acetamide Formula: C14H18ClN3O3 MolecularWeight: 311.76402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)CCl

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)CCl

InChI

InChI=1S/C14H18ClN3O3/c15-10-14(19)16-12-9-11(18(20)21)5-6-13(12)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8,10H2,(H,16,19)