[(1S,2R)-2-phenylcyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate

Systemtic Name: [(1S,2R)-2-phenylcyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate Openeye Name: [(1S,2R)-2-phenylcyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate CAS Name: 2-(5-methoxy-2-nitrophenyl)-2-propenoic acid [(1S,2R)-2-phenylcyclohexyl] ester IUPAC Name: [(1S,2R)-2-phenylcyclohexyl] 2-(5-methoxy-2-nitrophenyl)prop-2-enoate Traditional Name: 2-(5-methoxy-2-nitro-phenyl)acrylic acid [(1S,2R)-2-phenylcyclohexyl] ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+](=O)[O-])C(=C)C(=O)OC2CCCCC2C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)[N+](=O)[O-])C(=C)C(=O)O[C@H]2CCCC[C@@H]2C3=CC=CC=C3

InChI

InChI=1S/C22H23NO5/c1-15(19-14-17(27-2)12-13-20(19)23(25)26)22(24)28-21-11-7-6-10-18(21)16-8-4-3-5-9-16/h3-5,8-9,12-14,18,21H,1,6-7,10-11H2,2H3/t18-,21+/m1/s1