2-[(4-carbamimidoylphenyl)carbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[(4-carbamimidoylanilino)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-3-phenylpropanoic acid Traditional Name: 2-[(4-amidinophenyl)carbamoylamino]-3-phenyl-propionic acid Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

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