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

Systemtic Name: 4-(azepan-1-yl)-N-naphthalen-2-yl-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-(2-naphthyl)-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-(2-naphthalenyl)-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-naphthalen-2-yl-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-(2-naphthyl)-3-nitro-benzamide Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O3/c27-23(24-20-11-9-17-7-3-4-8-18(17)15-20)19-10-12-21(22(16-19)26(28)29)25-13-5-1-2-6-14-25/h3-4,7-12,15-16H,1-2,5-6,13-14H2,(H,24,27)