6-[(2-methylpropan-2-yl)oxy]-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 6-[(2-methylpropan-2-yl)oxy]-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 6-tert-butoxy-2-isobutyl-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 6-[(2-methylpropan-2-yl)oxy]-2-(2-methylpropyl)-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 6-[(2-methylpropan-2-yl)oxy]-2-(2-methylpropyl)-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 6-tert-butoxy-2-isobutyl-1-keto-4-phenyl-isoquinoline-3-carbonitrile Formula: C24H26N2O2 MolecularWeight: 374.47544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)OC(C)(C)C)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)OC(C)(C)C)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H26N2O2/c1-16(2)15-26-21(14-25)22(17-9-7-6-8-10-17)20-13-18(28-24(3,4)5)11-12-19(20)23(26)27/h6-13,16H,15H2,1-5H3