(4S)-4-(2-iodanylphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile

Systemtic Name: (4S)-4-(2-iodanylphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Openeye Name: (4S)-4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile CAS Name: (4S)-4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile IUPAC Name: (4S)-4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Traditional Name: (4S)-4-(2-iodophenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Formula: C17H15IN2O MolecularWeight: 390.21827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C#N)C3=CC=CC=C3I)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C#N)C3=CC=CC=C3I)C(=O)CCC2

InChI

InChI=1S/C17H15IN2O/c1-10-12(9-19)16(11-5-2-3-6-13(11)18)17-14(20-10)7-4-8-15(17)21/h2-3,5-6,12,16H,4,7-8H2,1H3/t12?,16-/m0/s1