5-[bis(azanyl)methylideneamino]-2-[bis(phenylcarbonyl)amino]pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[bis(phenylcarbonyl)amino]pentanoic acid Openeye Name: 2-(dibenzoylamino)-5-guanidino-pentanoic acid CAS Name: 5-(diaminomethylideneamino)-2-(dibenzoylamino)pentanoic acid IUPAC Name: 5-(diaminomethylideneamino)-2-(dibenzoylamino)pentanoic acid Traditional Name: 2-(dibenzoylamino)-5-guanidino-valeric acid Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(C(CCCN=C(N)N)C(=O)O)C(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(C(CCCN=C(N)N)C(=O)O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N4O4/c21-20(22)23-13-7-12-16(19(27)28)24(17(25)14-8-3-1-4-9-14)18(26)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13H2,(H,27,28)(H4,21,22,23)