2,2-dimethyl-3-oxidanyl-4-[2-oxidanylidene-4,5-bis(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-[2-oxidanylidene-4,5-bis(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[4,5-bis(benzyloxymethyl)-2-oxo-1-pyridyl]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-[2-oxo-4,5-bis(phenylmethoxymethyl)-1-pyridinyl]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-[2-oxo-4,5-bis(phenylmethoxymethyl)pyridin-1-yl]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[4,5-bis(benzoxymethyl)-2-keto-1-pyridyl]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C33H32N2O5 MolecularWeight: 536.61758

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C(=CC3=O)COCC4=CC=CC=C4)COCC5=CC=CC=C5)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C(=CC3=O)COCC4=CC=CC=C4)COCC5=CC=CC=C5)O)C

InChI

InChI=1S/C33H32N2O5/c1-33(2)32(37)31(28-15-25(17-34)13-14-29(28)40-33)35-18-27(22-39-20-24-11-7-4-8-12-24)26(16-30(35)36)21-38-19-23-9-5-3-6-10-23/h3-16,18,31-32,37H,19-22H2,1-2H3