3-(2-carbamimidoylphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(2-carbamimidoylphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(2-carbamimidoylphenyl)propanoic acid CAS Name: 3-(2-carbamimidoylphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(2-carbamimidoylphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-(2-amidinophenyl)-2-(benzyloxycarbonylamino)propionic acid Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=CC=C2C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=CC=C2C(=N)N)C(=O)O

InChI

InChI=1S/C18H19N3O4/c19-16(20)14-9-5-4-8-13(14)10-15(17(22)23)21-18(24)25-11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H3,19,20)(H,21,24)(H,22,23)