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

Systemtic Name: 4-azanyl-5-[4-(4-carbamimidoylphenyl)butylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[4-(4-carbamimidoylphenyl)butylamino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[4-(4-carbamimidoylphenyl)butylamino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[4-(4-carbamimidoylphenyl)butylamino]-5-oxopentanoic acid Traditional Name: 5-[4-(4-amidinophenyl)butylamino]-4-amino-5-keto-valeric acid Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O3/c17-13(8-9-14(21)22)16(23)20-10-2-1-3-11-4-6-12(7-5-11)15(18)19/h4-7,13H,1-3,8-10,17H2,(H3,18,19)(H,20,23)(H,21,22)