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

Systemtic Name: 4-azanyl-7-[bis(azanyl)methylideneamino]-2-(butylamino)-3-oxidanylidene-heptanoic acid Openeye Name: 4-amino-2-(butylamino)-7-guanidino-3-oxo-heptanoic acid CAS Name: 4-amino-2-(butylamino)-7-(diaminomethylideneamino)-3-oxoheptanoic acid IUPAC Name: 4-amino-2-(butylamino)-7-(diaminomethylideneamino)-3-oxoheptanoic acid Traditional Name: 4-amino-2-(butylamino)-7-guanidino-3-keto-enanthic acid Formula: C12H25N5O3 MolecularWeight: 287.3586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25N5O3/c1-2-3-6-16-9(11(19)20)10(18)8(13)5-4-7-17-12(14)15/h8-9,16H,2-7,13H2,1H3,(H,19,20)(H4,14,15,17)