methyl 4-[1-azanyl-2-(5-azanyl-2-methoxy-pyridin-4-yl)-2-oxidanylidene-ethyl]benzoate

Systemtic Name: methyl 4-[1-azanyl-2-(5-azanyl-2-methoxy-pyridin-4-yl)-2-oxidanylidene-ethyl]benzoate Openeye Name: methyl 4-[1-amino-2-(5-amino-2-methoxy-4-pyridyl)-2-oxo-ethyl]benzoate CAS Name: 4-[1-amino-2-(5-amino-2-methoxy-4-pyridinyl)-2-oxoethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-amino-2-(5-amino-2-methoxypyridin-4-yl)-2-oxoethyl]benzoate Traditional Name: 4-[1-amino-2-(5-amino-2-methoxy-4-pyridyl)-2-keto-ethyl]benzoic acid methyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C(=C1)C(=O)C(C2=CC=C(C=C2)C(=O)OC)N)N

Isomeric SMILES

COC1=NC=C(C(=C1)C(=O)C(C2=CC=C(C=C2)C(=O)OC)N)N

InChI

InChI=1S/C16H17N3O4/c1-22-13-7-11(12(17)8-19-13)15(20)14(18)9-3-5-10(6-4-9)16(21)23-2/h3-8,14H,17-18H2,1-2H3