[(E)-(2-cyclohexyl-1-nitro-ethylidene)amino] 4-phenylbenzoate

Systemtic Name: [(E)-(2-cyclohexyl-1-nitro-ethylidene)amino] 4-phenylbenzoate Openeye Name: [(E)-(2-cyclohexyl-1-nitro-ethylidene)amino] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [(E)-(2-cyclohexyl-1-nitroethylidene)amino] ester IUPAC Name: [(E)-(2-cyclohexyl-1-nitroethylidene)amino] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [(E)-(2-cyclohexyl-1-nitro-ethylidene)amino] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=NOC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C/C(=N\OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)/[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O4/c24-21(19-13-11-18(12-14-19)17-9-5-2-6-10-17)27-22-20(23(25)26)15-16-7-3-1-4-8-16/h2,5-6,9-14,16H,1,3-4,7-8,15H2/b22-20+