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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)OCCCCCCCN2C(=O)C3=CC=CC=C3C2=O)C)C4=CC=CC=C4C

Isomeric SMILES

CC1=C(C(=C(C=C1)OCCCCCCCN2C(=O)C3=CC=CC=C3C2=O)C)C4=CC=CC=C4C

InChI

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