4-methyl-4-(2-methylpropyl)isoquinoline-1,3-dione

Systemtic Name: 4-methyl-4-(2-methylpropyl)isoquinoline-1,3-dione Openeye Name: 4-isobutyl-4-methyl-isoquinoline-1,3-dione CAS Name: 4-methyl-4-(2-methylpropyl)isoquinoline-1,3-dione IUPAC Name: 4-methyl-4-(2-methylpropyl)isoquinoline-1,3-dione Traditional Name: 4-isobutyl-4-methyl-isoquinoline-1,3-quinone Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C2=CC=CC=C2C(=O)NC1=O)C

Isomeric SMILES

CC(C)CC1(C2=CC=CC=C2C(=O)NC1=O)C

InChI

InChI=1S/C14H17NO2/c1-9(2)8-14(3)11-7-5-4-6-10(11)12(16)15-13(14)17/h4-7,9H,8H2,1-3H3,(H,15,16,17)