methyl 2-azanyl-8-oxidanylidene-4-pyridin-3-yl-4,5,6,7-tetrahydrochromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-8-oxidanylidene-4-pyridin-3-yl-4,5,6,7-tetrahydrochromene-3-carboxylate Openeye Name: methyl 2-amino-8-oxo-4-(3-pyridyl)-4,5,6,7-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-8-oxo-4-(3-pyridinyl)-4,5,6,7-tetrahydro-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-8-oxo-4-pyridin-3-yl-4,5,6,7-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-8-keto-4-(3-pyridyl)-4,5,6,7-tetrahydrochromene-3-carboxylic acid methyl ester Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C3=CN=CC=C3)CCCC2=O)N

Isomeric SMILES

COC(=O)C1=C(OC2=C(C1C3=CN=CC=C3)CCCC2=O)N

InChI

InChI=1S/C16H16N2O4/c1-21-16(20)13-12(9-4-3-7-18-8-9)10-5-2-6-11(19)14(10)22-15(13)17/h3-4,7-8,12H,2,5-6,17H2,1H3