2-[(3S)-7-chloranyl-5,8-dimethoxy-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanenitrile

Systemtic Name: 2-[(3S)-7-chloranyl-5,8-dimethoxy-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanenitrile Openeye Name: 2-[(3S)-7-chloro-5,8-dimethoxy-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile CAS Name: 2-[(3S)-7-chloro-5,8-dimethoxy-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile IUPAC Name: 2-[(3S)-7-chloro-5,8-dimethoxy-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetonitrile Traditional Name: 2-[(3S)-7-chloro-2-keto-5,8-dimethoxy-3,4-dihydro-1H-quinolin-3-yl]acetonitrile Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=C1CC(C(=O)N2)CC#N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C2=C1C[C@H](C(=O)N2)CC#N)OC)Cl

InChI

InChI=1S/C13H13ClN2O3/c1-18-10-6-9(14)12(19-2)11-8(10)5-7(3-4-15)13(17)16-11/h6-7H,3,5H2,1-2H3,(H,16,17)/t7-/m1/s1