4-azanyl-7-[bis(azanyl)methylideneamino]-2-(butylamino)-2-methyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 4-azanyl-7-[bis(azanyl)methylideneamino]-2-(butylamino)-2-methyl-3-oxidanylidene-heptanoic acid Openeye Name: 4-amino-2-(butylamino)-7-guanidino-2-methyl-3-oxo-heptanoic acid CAS Name: 4-amino-2-(butylamino)-7-(diaminomethylideneamino)-2-methyl-3-oxoheptanoic acid IUPAC Name: 4-amino-2-(butylamino)-7-(diaminomethylideneamino)-2-methyl-3-oxoheptanoic acid Traditional Name: 4-amino-2-(butylamino)-7-guanidino-3-keto-2-methyl-enanthic acid Formula: C13H27N5O3 MolecularWeight: 301.38518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C)(C(=O)C(CCCN=C(N)N)N)C(=O)O

Isomeric SMILES

CCCCNC(C)(C(=O)C(CCCN=C(N)N)N)C(=O)O

InChI

InChI=1S/C13H27N5O3/c1-3-4-8-18-13(2,11(20)21)10(19)9(14)6-5-7-17-12(15)16/h9,18H,3-8,14H2,1-2H3,(H,20,21)(H4,15,16,17)