4-[(4-carbamimidoylpyridin-3-yl)amino]-2-phenoxy-butanoic acid

Systemtic Name: 4-[(4-carbamimidoylpyridin-3-yl)amino]-2-phenoxy-butanoic acid Openeye Name: 4-[(4-carbamimidoyl-3-pyridyl)amino]-2-phenoxy-butanoic acid CAS Name: 4-[(4-carbamimidoyl-3-pyridinyl)amino]-2-phenoxybutanoic acid IUPAC Name: 4-[(4-carbamimidoylpyridin-3-yl)amino]-2-phenoxybutanoic acid Traditional Name: 4-[(4-amidino-3-pyridyl)amino]-2-phenoxy-butyric acid Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CCNC2=C(C=CN=C2)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(CCNC2=C(C=CN=C2)C(=N)N)C(=O)O

InChI

InChI=1S/C16H18N4O3/c17-15(18)12-6-8-19-10-13(12)20-9-7-14(16(21)22)23-11-4-2-1-3-5-11/h1-6,8,10,14,20H,7,9H2,(H3,17,18)(H,21,22)