[(3R)-3-[(4-methylphenyl)amino]-3-phenyl-propyl] 4-methoxy-3-nitro-benzoate

Systemtic Name: [(3R)-3-[(4-methylphenyl)amino]-3-phenyl-propyl] 4-methoxy-3-nitro-benzoate Openeye Name: [(3R)-3-(4-methylanilino)-3-phenyl-propyl] 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid [(3R)-3-(4-methylanilino)-3-phenylpropyl] ester IUPAC Name: [(3R)-3-(4-methylanilino)-3-phenylpropyl] 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid [(3R)-3-phenyl-3-(p-toluidino)propyl] ester Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(CCOC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N[C@H](CCOC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C24H24N2O5/c1-17-8-11-20(12-9-17)25-21(18-6-4-3-5-7-18)14-15-31-24(27)19-10-13-23(30-2)22(16-19)26(28)29/h3-13,16,21,25H,14-15H2,1-2H3/t21-/m1/s1