4-(azepan-1-yl)-N-methyl-3-nitro-N-phenyl-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-methyl-3-nitro-N-phenyl-benzamide Openeye Name: 4-(azepan-1-yl)-N-methyl-3-nitro-N-phenyl-benzamide CAS Name: 4-(1-azepanyl)-N-methyl-3-nitro-N-phenylbenzamide IUPAC Name: 4-(azepan-1-yl)-N-methyl-3-nitro-N-phenylbenzamide Traditional Name: 4-(azepan-1-yl)-N-methyl-3-nitro-N-phenyl-benzamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3/c1-21(17-9-5-4-6-10-17)20(24)16-11-12-18(19(15-16)23(25)26)22-13-7-2-3-8-14-22/h4-6,9-12,15H,2-3,7-8,13-14H2,1H3