ethyl 2-[2-[bis(azanyl)methylideneamino]-2-oxidanylidene-ethanoyl]-6-phenyl-hexanoate

Systemtic Name: ethyl 2-[2-[bis(azanyl)methylideneamino]-2-oxidanylidene-ethanoyl]-6-phenyl-hexanoate Openeye Name: ethyl 2-(2-guanidino-2-oxo-acetyl)-6-phenyl-hexanoate CAS Name: 2-[2-(diaminomethylideneamino)-1,2-dioxoethyl]-6-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 2-[2-(diaminomethylideneamino)-2-oxoacetyl]-6-phenylhexanoate Traditional Name: 2-(2-guanidino-2-keto-acetyl)-6-phenyl-hexanoic acid ethyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCC1=CC=CC=C1)C(=O)C(=O)N=C(N)N

Isomeric SMILES

CCOC(=O)C(CCCCC1=CC=CC=C1)C(=O)C(=O)N=C(N)N

InChI

InChI=1S/C17H23N3O4/c1-2-24-16(23)13(14(21)15(22)20-17(18)19)11-7-6-10-12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H4,18,19,20,22)