3-(azepan-1-ylsulfonyl)-N-(4-nitrophenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-nitrophenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-nitrophenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4-nitrophenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-nitrophenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-nitrophenyl)benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c23-19(20-16-8-10-17(11-9-16)22(24)25)15-6-5-7-18(14-15)28(26,27)21-12-3-1-2-4-13-21/h5-11,14H,1-4,12-13H2,(H,20,23)