[(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-butoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-butoxyphenyl)carbonylamino]ethanoate Openeye Name: [(1R)-2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-[(4-butoxybenzoyl)amino]acetate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]acetic acid [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] 2-[(4-butoxybenzoyl)amino]acetate Traditional Name: 2-[(4-butoxybenzoyl)amino]acetic acid [(1R)-2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C24H29NO5 MolecularWeight: 411.49076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OC(C)C(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)O[C@H](C)C(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C24H29NO5/c1-5-6-13-29-21-11-9-19(10-12-21)24(28)25-15-22(26)30-18(4)23(27)20-8-7-16(2)17(3)14-20/h7-12,14,18H,5-6,13,15H2,1-4H3,(H,25,28)/t18-/m1/s1