2-[(4-cyanophenyl)carbamoylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[(4-cyanophenyl)carbamoylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[(4-cyanophenyl)carbamoylamino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(4-cyanophenyl)carbamoylamino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(4-cyanophenyl)carbamoylamino]-3-(1H-imidazol-5-yl)propionic acid Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)NC(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H13N5O3/c15-6-9-1-3-10(4-2-9)18-14(22)19-12(13(20)21)5-11-7-16-8-17-11/h1-4,7-8,12H,5H2,(H,16,17)(H,20,21)(H2,18,19,22)