2-[(4-carbamimidoylphenyl)amino]-2-[2-(carboxymethyloxy)-5-methoxy-phenyl]ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[2-(carboxymethyloxy)-5-methoxy-phenyl]ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-[2-(carboxymethyloxy)-5-methoxy-phenyl]acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-[2-(carboxymethyloxy)-5-methoxyphenyl]acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-[2-(carboxymethyloxy)-5-methoxyphenyl]acetic acid Traditional Name: 2-(4-amidinoanilino)-2-[2-(carboxymethyloxy)-5-methoxy-phenyl]acetic acid Formula: C18H19N3O6 MolecularWeight: 373.35996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(=O)O)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(=O)O)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H19N3O6/c1-26-12-6-7-14(27-9-15(22)23)13(8-12)16(18(24)25)21-11-4-2-10(3-5-11)17(19)20/h2-8,16,21H,9H2,1H3,(H3,19,20)(H,22,23)(H,24,25)