5-[4-(4-carbamimidoylphenyl)butylamino]-4-oxidanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-(4-carbamimidoylphenyl)butylamino]-4-oxidanyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(4-carbamimidoylphenyl)butylamino]-4-hydroxy-5-oxo-pentanoic acid CAS Name: 5-[4-(4-carbamimidoylphenyl)butylamino]-4-hydroxy-5-oxopentanoic acid IUPAC Name: 5-[4-(4-carbamimidoylphenyl)butylamino]-4-hydroxy-5-oxopentanoic acid Traditional Name: 5-[4-(4-amidinophenyl)butylamino]-4-hydroxy-5-keto-valeric acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCNC(=O)C(CCC(=O)O)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CCCCNC(=O)C(CCC(=O)O)O)C(=N)N

InChI

InChI=1S/C16H23N3O4/c17-15(18)12-6-4-11(5-7-12)3-1-2-10-19-16(23)13(20)8-9-14(21)22/h4-7,13,20H,1-3,8-10H2,(H3,17,18)(H,19,23)(H,21,22)