2-(methoxymethyl)-2,3-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-4H-chromene-6-carbonitrile

Systemtic Name: 2-(methoxymethyl)-2,3-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-4H-chromene-6-carbonitrile Openeye Name: 3-hydroxy-2-(methoxymethyl)-2,3-dimethyl-4-(2-oxopyrrolidin-1-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2-(methoxymethyl)-2,3-dimethyl-4-(2-oxo-1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2-(methoxymethyl)-2,3-dimethyl-4-(2-oxopyrrolidin-1-yl)-4H-chromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(2-ketopyrrolidino)-2-(methoxymethyl)-2,3-dimethyl-chroman-6-carbonitrile Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCCC3=O)(C)O)COC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCCC3=O)(C)O)COC

InChI

InChI=1S/C18H22N2O4/c1-17(11-23-3)18(2,22)16(20-8-4-5-15(20)21)13-9-12(10-19)6-7-14(13)24-17/h6-7,9,16,22H,4-5,8,11H2,1-3H3