(3S)-2,2-dimethyl-3-oxidanyl-5-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3S)-2,2-dimethyl-3-oxidanyl-5-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3S)-3-hydroxy-2,2-dimethyl-5-(2-oxopyrrolidin-1-yl)chromane-6-carbonitrile CAS Name: (3S)-3-hydroxy-2,2-dimethyl-5-(2-oxo-1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3S)-3-hydroxy-2,2-dimethyl-5-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3S)-3-hydroxy-5-(2-ketopyrrolidino)-2,2-dimethyl-chroman-6-carbonitrile Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=CC(=C2N3CCCC3=O)C#N)O)C

Isomeric SMILES

CC1([C@H](CC2=C(O1)C=CC(=C2N3CCCC3=O)C#N)O)C

InChI

InChI=1S/C16H18N2O3/c1-16(2)13(19)8-11-12(21-16)6-5-10(9-17)15(11)18-7-3-4-14(18)20/h5-6,13,19H,3-4,7-8H2,1-2H3/t13-/m0/s1