methyl 4-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methoxy]-3-nitro-benzoate CAS Name: 4-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]-3-nitrobenzoate Traditional Name: 4-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methoxy]-3-nitro-benzoic acid methyl ester Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C=C1

InChI

InChI=1S/C18H15N3O6/c1-11-3-6-16-19-13(8-17(22)20(16)9-11)10-27-15-5-4-12(18(23)26-2)7-14(15)21(24)25/h3-9H,10H2,1-2H3