2-[[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[3-(4-cyanoanilino)-3-oxo-propyl]-methyl-amino]acetic acid CAS Name: 2-[[3-(4-cyanoanilino)-3-oxopropyl]-methylamino]acetic acid IUPAC Name: 2-[[3-(4-cyanoanilino)-3-oxopropyl]-methylamino]acetic acid Traditional Name: 2-[[3-(4-cyanoanilino)-3-keto-propyl]-methyl-amino]acetic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=CC=C(C=C1)C#N)CC(=O)O

Isomeric SMILES

CN(CCC(=O)NC1=CC=C(C=C1)C#N)CC(=O)O

InChI

InChI=1S/C13H15N3O3/c1-16(9-13(18)19)7-6-12(17)15-11-4-2-10(8-14)3-5-11/h2-5H,6-7,9H2,1H3,(H,15,17)(H,18,19)