2-[(4-ethoxycarbonylphenyl)carbonylamino]-4-(2-methylpropanoylamino)benzoic acid

Systemtic Name: 2-[(4-ethoxycarbonylphenyl)carbonylamino]-4-(2-methylpropanoylamino)benzoic acid Openeye Name: 2-[(4-ethoxycarbonylbenzoyl)amino]-4-(2-methylpropanoylamino)benzoic acid CAS Name: 2-[[(4-ethoxycarbonylphenyl)-oxomethyl]amino]-4-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 2-[(4-ethoxycarbonylbenzoyl)amino]-4-(2-methylpropanoylamino)benzoic acid Traditional Name: 2-[(4-carbethoxybenzoyl)amino]-4-(isobutyrylamino)benzoic acid Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C(C)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C(C)C)C(=O)O

InChI

InChI=1S/C21H22N2O6/c1-4-29-21(28)14-7-5-13(6-8-14)19(25)23-17-11-15(22-18(24)12(2)3)9-10-16(17)20(26)27/h5-12H,4H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)