2-[(4-cyanophenyl)carbamoylamino]butanedioic acid

Systemtic Name: 2-[(4-cyanophenyl)carbamoylamino]butanedioic acid Openeye Name: 2-[(4-cyanophenyl)carbamoylamino]butanedioic acid CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]amino]butanedioic acid IUPAC Name: 2-[(4-cyanophenyl)carbamoylamino]butanedioic acid Traditional Name: 2-[(4-cyanophenyl)carbamoylamino]succinic acid Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H11N3O5/c13-6-7-1-3-8(4-2-7)14-12(20)15-9(11(18)19)5-10(16)17/h1-4,9H,5H2,(H,16,17)(H,18,19)(H2,14,15,20)