4-[[4-(3-methylbutoxy)phenyl]methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[4-(3-methylbutoxy)phenyl]methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[(4-isopentyloxyphenyl)methylene]-2-(m-tolyl)isoquinoline-1,3-dione CAS Name: 4-[[4-(3-methylbutoxy)phenyl]methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[[4-(3-methylbutoxy)phenyl]methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione Traditional Name: 4-(4-isoamoxybenzylidene)-2-(m-tolyl)isoquinoline-1,3-quinone Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC=C(C=C4)OCCC(C)C)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC=C(C=C4)OCCC(C)C)C2=O

InChI

InChI=1S/C28H27NO3/c1-19(2)15-16-32-23-13-11-21(12-14-23)18-26-24-9-4-5-10-25(24)27(30)29(28(26)31)22-8-6-7-20(3)17-22/h4-14,17-19H,15-16H2,1-3H3