[(2R)-1-[(3,4-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-butylphenyl)ethanoate

Systemtic Name: [(2R)-1-[(3,4-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-butylphenyl)ethanoate Openeye Name: [(1R)-2-(3,4-dimethoxyanilino)-1-methyl-2-oxo-ethyl] 2-(4-butylphenyl)acetate CAS Name: 2-(4-butylphenyl)acetic acid [(2R)-1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl] 2-(4-butylphenyl)acetate Traditional Name: 2-(4-butylphenyl)acetic acid [(1R)-2-(3,4-dimethoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)OC(C)C(=O)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)O[C@H](C)C(=O)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C23H29NO5/c1-5-6-7-17-8-10-18(11-9-17)14-22(25)29-16(2)23(26)24-19-12-13-20(27-3)21(15-19)28-4/h8-13,15-16H,5-7,14H2,1-4H3,(H,24,26)/t16-/m1/s1