2-(azepan-2-yl)-N-(2-chloranyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(azepan-2-yl)-N-(2-chloranyl-4-nitro-phenyl)ethanamide Openeye Name: 2-(azepan-2-yl)-N-(2-chloro-4-nitro-phenyl)acetamide CAS Name: 2-(2-azepanyl)-N-(2-chloro-4-nitrophenyl)acetamide IUPAC Name: 2-(azepan-2-yl)-N-(2-chloro-4-nitrophenyl)acetamide Traditional Name: 2-(azepan-2-yl)-N-(2-chloro-4-nitro-phenyl)acetamide Formula: C14H18ClN3O3 MolecularWeight: 311.76402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NCC1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(NCC1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

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