3-methyl-1-(2-methylpropyl)-2-naphthalen-1-ylcarbonyl-isoquinoline-1-carbonitrile

Systemtic Name: 3-methyl-1-(2-methylpropyl)-2-naphthalen-1-ylcarbonyl-isoquinoline-1-carbonitrile Openeye Name: 1-isobutyl-3-methyl-2-(naphthalene-1-carbonyl)isoquinoline-1-carbonitrile CAS Name: 3-methyl-1-(2-methylpropyl)-2-[1-naphthalenyl(oxo)methyl]-1-isoquinolinecarbonitrile IUPAC Name: 3-methyl-1-(2-methylpropyl)-2-(naphthalene-1-carbonyl)isoquinoline-1-carbonitrile Traditional Name: 1-isobutyl-3-methyl-2-(1-naphthoyl)isoquinoline-1-carbonitrile Formula: C26H24N2O MolecularWeight: 380.48156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(N1C(=O)C3=CC=CC4=CC=CC=C43)(CC(C)C)C#N

Isomeric SMILES

CC1=CC2=CC=CC=C2C(N1C(=O)C3=CC=CC4=CC=CC=C43)(CC(C)C)C#N

InChI

InChI=1S/C26H24N2O/c1-18(2)16-26(17-27)24-14-7-5-10-21(24)15-19(3)28(26)25(29)23-13-8-11-20-9-4-6-12-22(20)23/h4-15,18H,16H2,1-3H3