2,2-bis(methoxymethyl)-3-oxidanyl-4-[(6-oxidanylidene-1H-pyridin-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-bis(methoxymethyl)-3-oxidanyl-4-[(6-oxidanylidene-1H-pyridin-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-[(6-oxo-1H-pyridin-3-yl)amino]chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-[(6-oxo-1H-pyridin-3-yl)amino]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-bis(methoxymethyl)-4-[(6-oxo-1H-pyridin-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[(6-keto-1H-pyridin-3-yl)amino]-2,2-bis(methoxymethyl)chroman-6-carbonitrile Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CNC(=O)C=C3)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CNC(=O)C=C3)O)COC

InChI

InChI=1S/C19H21N3O5/c1-25-10-19(11-26-2)18(24)17(22-13-4-6-16(23)21-9-13)14-7-12(8-20)3-5-15(14)27-19/h3-7,9,17-18,22,24H,10-11H2,1-2H3,(H,21,23)