2-(3-phenylazanylpropanoylamino)butanedioic acid

Systemtic Name: 2-(3-phenylazanylpropanoylamino)butanedioic acid Openeye Name: 2-(3-anilinopropanoylamino)butanedioic acid CAS Name: 2-[(3-anilino-1-oxopropyl)amino]butanedioic acid IUPAC Name: 2-(3-anilinopropanoylamino)butanedioic acid Traditional Name: 2-(3-anilinopropanoylamino)succinic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCCC(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NCCC(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C13H16N2O5/c16-11(15-10(13(19)20)8-12(17)18)6-7-14-9-4-2-1-3-5-9/h1-5,10,14H,6-8H2,(H,15,16)(H,17,18)(H,19,20)