[2-azanyl-2-(4-carbamimidoylphenyl)-3-(1H-imidazol-2-yl)propanoyl] 4-azanyl-4-oxidanylidene-butanoate

Systemtic Name: [2-azanyl-2-(4-carbamimidoylphenyl)-3-(1H-imidazol-2-yl)propanoyl] 4-azanyl-4-oxidanylidene-butanoate Openeye Name: [2-amino-2-(4-carbamimidoylphenyl)-3-(1H-imidazol-2-yl)propanoyl] 4-amino-4-oxo-butanoate CAS Name: 4-amino-4-oxobutanoic acid [2-amino-2-(4-carbamimidoylphenyl)-3-(1H-imidazol-2-yl)-1-oxopropyl] ester IUPAC Name: [2-amino-2-(4-carbamimidoylphenyl)-3-(1H-imidazol-2-yl)propanoyl] 4-amino-4-oxobutanoate Traditional Name: 4-amino-4-keto-butyric acid [2-(4-amidinophenyl)-2-amino-3-(1H-imidazol-2-yl)propanoyl] ester Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)C(CC2=NC=CN2)(C(=O)OC(=O)CCC(=O)N)N

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)C(CC2=NC=CN2)(C(=O)OC(=O)CCC(=O)N)N

InChI

InChI=1S/C17H20N6O4/c18-12(24)5-6-14(25)27-16(26)17(21,9-13-22-7-8-23-13)11-3-1-10(2-4-11)15(19)20/h1-4,7-8H,5-6,9,21H2,(H2,18,24)(H3,19,20)(H,22,23)