[4-(azepan-1-yl)-3-nitro-phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone

Systemtic Name: [4-(azepan-1-yl)-3-nitro-phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone Openeye Name: [4-(azepan-1-yl)-3-nitro-phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone CAS Name: [4-(1-azepanyl)-3-nitrophenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone IUPAC Name: [4-(azepan-1-yl)-3-nitrophenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone Traditional Name: [4-(azepan-1-yl)-3-nitro-phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC(=CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC(=CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O3/c28-24(26-16-12-20(13-17-26)19-8-4-3-5-9-19)21-10-11-22(23(18-21)27(29)30)25-14-6-1-2-7-15-25/h3-5,8-12,18H,1-2,6-7,13-17H2