(4S)-2-azanyl-4-(2-bromophenyl)-7,7-dimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(2-bromophenyl)-7,7-dimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4S)-2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4S)-2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(2-bromophenyl)-7,7-dimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4S)-2-amino-4-(2-bromophenyl)-5-keto-7,7-dimethyl-3,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C18H18BrN3O MolecularWeight: 372.25902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(C(=N2)N)C#N)C3=CC=CC=C3Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(C(=N2)N)C#N)C3=CC=CC=C3Br)C(=O)C1)C

InChI

InChI=1S/C18H18BrN3O/c1-18(2)7-13-16(14(23)8-18)15(11(9-20)17(21)22-13)10-5-3-4-6-12(10)19/h3-6,11,15H,7-8H2,1-2H3,(H2,21,22)/t11?,15-/m0/s1