2-[(3S)-6-tert-butyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanenitrile

Systemtic Name: 2-[(3S)-6-tert-butyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanenitrile Openeye Name: 2-[(3S)-6-tert-butyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile CAS Name: 2-[(3S)-6-tert-butyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile IUPAC Name: 2-[(3S)-6-tert-butyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile Traditional Name: 2-[(3S)-6-tert-butyl-2-keto-3,4-dihydro-1H-quinolin-3-yl]acetonitrile Formula: C15H18N2O MolecularWeight: 242.31622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=O)C(C2)CC#N

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=O)[C@@H](C2)CC#N

InChI

InChI=1S/C15H18N2O/c1-15(2,3)12-4-5-13-11(9-12)8-10(6-7-16)14(18)17-13/h4-5,9-10H,6,8H2,1-3H3,(H,17,18)/t10-/m1/s1