2-[7-[3,5-dimethyl-4-(2-methylphenyl)phenoxy]heptyl]isoindole-1,3-dione

Systemtic Name: 2-[7-[3,5-dimethyl-4-(2-methylphenyl)phenoxy]heptyl]isoindole-1,3-dione Openeye Name: 2-[7-[3,5-dimethyl-4-(o-tolyl)phenoxy]heptyl]isoindoline-1,3-dione CAS Name: 2-[7-[3,5-dimethyl-4-(2-methylphenyl)phenoxy]heptyl]isoindole-1,3-dione IUPAC Name: 2-[7-[3,5-dimethyl-4-(2-methylphenyl)phenoxy]heptyl]isoindole-1,3-dione Traditional Name: 2-[7-[3,5-dimethyl-4-(o-tolyl)phenoxy]heptyl]isoindoline-1,3-quinone Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=C(C=C2C)OCCCCCCCN3C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=C(C=C2C)OCCCCCCCN3C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C30H33NO3/c1-21-13-7-8-14-25(21)28-22(2)19-24(20-23(28)3)34-18-12-6-4-5-11-17-31-29(32)26-15-9-10-16-27(26)30(31)33/h7-10,13-16,19-20H,4-6,11-12,17-18H2,1-3H3