ethyl 4-(5-oxidanylidene-2-piperidin-1-yl-pyrido[4,3-d]pyrimidin-6-yl)benzoate

Systemtic Name: ethyl 4-(5-oxidanylidene-2-piperidin-1-yl-pyrido[4,3-d]pyrimidin-6-yl)benzoate Openeye Name: ethyl 4-[5-oxo-2-(1-piperidyl)pyrido[4,3-d]pyrimidin-6-yl]benzoate CAS Name: 4-[5-oxo-2-(1-piperidinyl)-6-pyrido[4,3-d]pyrimidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-oxo-2-piperidin-1-ylpyrido[4,3-d]pyrimidin-6-yl)benzoate Traditional Name: 4-(5-keto-2-piperidino-pyrido[4,3-d]pyrimidin-6-yl)benzoic acid ethyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=CC3=NC(=NC=C3C2=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=CC3=NC(=NC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C21H22N4O3/c1-2-28-20(27)15-6-8-16(9-7-15)25-13-10-18-17(19(25)26)14-22-21(23-18)24-11-4-3-5-12-24/h6-10,13-14H,2-5,11-12H2,1H3