(4R,4aS,5S)-5-methyl-5-oxidanyl-4-(2-oxidanylpropan-2-yl)-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile

Systemtic Name: (4R,4aS,5S)-5-methyl-5-oxidanyl-4-(2-oxidanylpropan-2-yl)-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile Openeye Name: (4R,4aS,5S)-5-hydroxy-4-(1-hydroxy-1-methyl-ethyl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile CAS Name: (4R,4aS,5S)-5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile IUPAC Name: (4R,4aS,5S)-5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile Traditional Name: (4R,4aS,5S)-5-hydroxy-4-(1-hydroxy-1-methyl-ethyl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2=CC(=CC(C21)C(C)(C)O)C#N)O

Isomeric SMILES

C[C@@]1(CCCC2=CC(=C[C@H]([C@@H]21)C(C)(C)O)C#N)O

InChI

InChI=1S/C15H21NO2/c1-14(2,17)12-8-10(9-16)7-11-5-4-6-15(3,18)13(11)12/h7-8,12-13,17-18H,4-6H2,1-3H3/t12-,13-,15+/m1/s1