4-azanyl-5-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 5-[[2-[(4-amidinobenzyl)amino]-2-keto-ethyl]amino]-4-amino-5-keto-valeric acid Formula: C15H21N5O4 MolecularWeight: 335.35834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CNC(=O)C(CCC(=O)O)N)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CNC(=O)C(CCC(=O)O)N)C(=N)N

InChI

InChI=1S/C15H21N5O4/c16-11(5-6-13(22)23)15(24)20-8-12(21)19-7-9-1-3-10(4-2-9)14(17)18/h1-4,11H,5-8,16H2,(H3,17,18)(H,19,21)(H,20,24)(H,22,23)