[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(3,4-diethoxyphenyl)carbonylbenzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(3,4-diethoxyphenyl)carbonylbenzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-(3,4-diethoxybenzoyl)benzoate CAS Name: 2-[(3,4-diethoxyphenyl)-oxomethyl]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(3,4-diethoxybenzoyl)benzoate Traditional Name: 2-(3,4-diethoxybenzoyl)benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H27NO6 MolecularWeight: 425.47428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OC(C)C(=O)NC3CC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O[C@H](C)C(=O)NC3CC3)OCC

InChI

InChI=1S/C24H27NO6/c1-4-29-20-13-10-16(14-21(20)30-5-2)22(26)18-8-6-7-9-19(18)24(28)31-15(3)23(27)25-17-11-12-17/h6-10,13-15,17H,4-5,11-12H2,1-3H3,(H,25,27)/t15-/m1/s1