[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(4-carbamoylanilino)-2-oxo-ethyl] (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(4-carbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylanilino)-2-oxoethyl] (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butyric acid [2-(4-carbamoylanilino)-2-keto-ethyl] ester Formula: C23H27N3O7 MolecularWeight: 457.47638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C23H27N3O7/c1-13(2)20(26-22(29)15-9-17(31-3)11-18(10-15)32-4)23(30)33-12-19(27)25-16-7-5-14(6-8-16)21(24)28/h5-11,13,20H,12H2,1-4H3,(H2,24,28)(H,25,27)(H,26,29)/t20-/m0/s1