2-[(3-carbamimidoylphenyl)carbonyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[(3-carbamimidoylphenyl)carbonyl-phenyl-amino]ethanoic acid Openeye Name: 2-(N-(3-carbamimidoylbenzoyl)anilino)acetic acid CAS Name: 2-(N-[(3-carbamimidoylphenyl)-oxomethyl]anilino)acetic acid IUPAC Name: 2-(N-(3-carbamimidoylbenzoyl)anilino)acetic acid Traditional Name: 2-(N-(3-amidinobenzoyl)anilino)acetic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC(=O)O)C(=O)C2=CC=CC(=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)N(CC(=O)O)C(=O)C2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C16H15N3O3/c17-15(18)11-5-4-6-12(9-11)16(22)19(10-14(20)21)13-7-2-1-3-8-13/h1-9H,10H2,(H3,17,18)(H,20,21)