azanyl 2-[azanyl(phenyl)methyl]-2-imidazol-1-yl-3,6-bis(oxidanylidene)hexanoate

Systemtic Name: azanyl 2-[azanyl(phenyl)methyl]-2-imidazol-1-yl-3,6-bis(oxidanylidene)hexanoate Openeye Name: amino 2-[amino(phenyl)methyl]-2-imidazol-1-yl-3,6-dioxo-hexanoate CAS Name: 2-[amino(phenyl)methyl]-2-(1-imidazolyl)-3,6-dioxohexanoic acid amino ester IUPAC Name: amino 2-[amino(phenyl)methyl]-2-imidazol-1-yl-3,6-dioxohexanoate Traditional Name: 2-[amino(phenyl)methyl]-2-imidazol-1-yl-3,6-diketo-hexanoic acid amino ester Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)CCC=O)(C(=O)ON)N2C=CN=C2)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)CCC=O)(C(=O)ON)N2C=CN=C2)N

InChI

InChI=1S/C16H18N4O4/c17-14(12-5-2-1-3-6-12)16(15(23)24-18,13(22)7-4-10-21)20-9-8-19-11-20/h1-3,5-6,8-11,14H,4,7,17-18H2