2-[[2-(benzamidomethyl)-5-carbamimidoyl-phenyl]amino]ethanoic acid

Systemtic Name: 2-[[2-(benzamidomethyl)-5-carbamimidoyl-phenyl]amino]ethanoic acid Openeye Name: 2-[2-(benzamidomethyl)-5-carbamimidoyl-anilino]acetic acid CAS Name: 2-[2-(benzamidomethyl)-5-carbamimidoylanilino]acetic acid IUPAC Name: 2-[2-(benzamidomethyl)-5-carbamimidoylanilino]acetic acid Traditional Name: 2-[5-amidino-2-(benzamidomethyl)anilino]acetic acid Formula: C17H18N4O3 MolecularWeight: 326.34982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O

InChI

InChI=1S/C17H18N4O3/c18-16(19)12-6-7-13(14(8-12)20-10-15(22)23)9-21-17(24)11-4-2-1-3-5-11/h1-8,20H,9-10H2,(H3,18,19)(H,21,24)(H,22,23)