4-(azepan-1-yl)-N-(2-chlorophenyl)-3-nitro-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-(2-chlorophenyl)-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-(2-chlorophenyl)-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-(2-chlorophenyl)-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-(2-chlorophenyl)-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-(2-chlorophenyl)-3-nitro-benzamide Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O3/c20-15-7-3-4-8-16(15)21-19(24)14-9-10-17(18(13-14)23(25)26)22-11-5-1-2-6-12-22/h3-4,7-10,13H,1-2,5-6,11-12H2,(H,21,24)