6-(2-nitro-1-phenyl-ethyl)-1-phenyl-2,3,4,5-tetrahydroazepine

Systemtic Name: 6-(2-nitro-1-phenyl-ethyl)-1-phenyl-2,3,4,5-tetrahydroazepine Openeye Name: 6-(2-nitro-1-phenyl-ethyl)-1-phenyl-2,3,4,5-tetrahydroazepine CAS Name: 6-(2-nitro-1-phenylethyl)-1-phenyl-2,3,4,5-tetrahydroazepine IUPAC Name: 6-(2-nitro-1-phenylethyl)-1-phenyl-2,3,4,5-tetrahydroazepine Traditional Name: 6-(2-nitro-1-phenyl-ethyl)-1-phenyl-2,3,4,5-tetrahydroazepine Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C=C(C1)C(C[N+](=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C=C(C1)C(C[N+](=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2/c23-22(24)16-20(17-9-3-1-4-10-17)18-11-7-8-14-21(15-18)19-12-5-2-6-13-19/h1-6,9-10,12-13,15,20H,7-8,11,14,16H2