2-azanyl-3-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazol-1-yl]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazol-1-yl]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazol-1-yl]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazol-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[3-(4-amidinophenyl)-2-keto-4-imidazolin-1-yl]phenyl]-2-amino-propionic acid Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)N2C=CN(C2=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)N2C=CN(C2=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H19N5O3/c20-16(18(25)26)11-12-1-5-14(6-2-12)23-9-10-24(19(23)27)15-7-3-13(4-8-15)17(21)22/h1-10,16H,11,20H2,(H3,21,22)(H,25,26)