2-[(2-carboxyphenyl)carbonylamino]-2-phenethyl-propanedioic acid

Systemtic Name: 2-[(2-carboxyphenyl)carbonylamino]-2-phenethyl-propanedioic acid Openeye Name: 2-[(2-carboxybenzoyl)amino]-2-phenethyl-propanedioic acid CAS Name: 2-[[(2-carboxyphenyl)-oxomethyl]amino]-2-phenethylpropanedioic acid IUPAC Name: 2-[(2-carboxybenzoyl)amino]-2-phenethylpropanedioic acid Traditional Name: 2-[(2-carboxybenzoyl)amino]-2-phenethyl-malonic acid Formula: C19H17NO7 MolecularWeight: 371.34078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)O)(C(=O)O)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)O)(C(=O)O)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H17NO7/c21-15(13-8-4-5-9-14(13)16(22)23)20-19(17(24)25,18(26)27)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)(H,22,23)(H,24,25)(H,26,27)