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

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[phenylcarbonyl(phenyldiazenyl)amino]pentanoic acid Openeye Name: 2-[benzoyl(phenylazo)amino]-5-guanidino-pentanoic acid CAS Name: 2-[benzoyl(phenyldiazenyl)amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[benzoyl(phenyldiazenyl)amino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-[benzoyl(phenylazo)amino]-5-guanidino-valeric acid Formula: C19H22N6O3 MolecularWeight: 382.41638

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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)N=NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(C(CCCN=C(N)N)C(=O)O)N=NC2=CC=CC=C2

InChI

InChI=1S/C19H22N6O3/c20-19(21)22-13-7-12-16(18(27)28)25(17(26)14-8-3-1-4-9-14)24-23-15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13H2,(H,27,28)(H4,20,21,22)