(3S,4R)-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromene-7-carbonitrile

Systemtic Name: (3S,4R)-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromene-7-carbonitrile Openeye Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(1-piperidyl)chromane-7-carbonitrile CAS Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(1-piperidinyl)-3,4-dihydro-2H-1-benzopyran-7-carbonitrile IUPAC Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-piperidin-1-yl-3,4-dihydrochromene-7-carbonitrile Traditional Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-piperidino-chroman-7-carbonitrile Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C(C=C2)C#N)N3CCCCC3)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=C(C=C2)C#N)N3CCCCC3)O)C

InChI

InChI=1S/C17H22N2O2/c1-17(2)16(20)15(19-8-4-3-5-9-19)13-7-6-12(11-18)10-14(13)21-17/h6-7,10,15-16,20H,3-5,8-9H2,1-2H3/t15-,16+/m1/s1