[(2R)-1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(2-methylpropyl)benzoate

Systemtic Name: [(2R)-1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(2-methylpropyl)benzoate Openeye Name: [(1R)-2-(2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethyl] 4-isobutylbenzoate CAS Name: 4-(2-methylpropyl)benzoic acid [(2R)-1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] 4-(2-methylpropyl)benzoate Traditional Name: 4-isobutylbenzoic acid [(1R)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-methyl-ethyl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@@H](C)OC(=O)C2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C22H27NO4/c1-14(2)12-17-7-9-18(10-8-17)22(25)27-16(4)21(24)23-19-13-15(3)6-11-20(19)26-5/h6-11,13-14,16H,12H2,1-5H3,(H,23,24)/t16-/m1/s1