(6S)-2-azanyl-6-tert-butyl-4-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: (6S)-2-azanyl-6-tert-butyl-4-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: (6S)-2-amino-6-tert-butyl-4-(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: (6S)-2-amino-6-tert-butyl-4-(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: (6S)-2-amino-6-tert-butyl-4-(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: (6S)-2-amino-6-tert-butyl-4-(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2C3=C(CCC(C3)C(C)(C)C)NC(=C2C#N)N)C=CC1=O

Isomeric SMILES

CCOC1=CC(=C2C3=C(CC[C@@H](C3)C(C)(C)C)NC(=C2C#N)N)C=CC1=O

InChI

InChI=1S/C22H27N3O2/c1-5-27-19-10-13(6-9-18(19)26)20-15-11-14(22(2,3)4)7-8-17(15)25-21(24)16(20)12-23/h6,9-10,14,25H,5,7-8,11,24H2,1-4H3/t14-/m0/s1