2-[8-(2-chloranyl-4-methyl-3-phenyl-phenoxy)octyl]isoindole-1,3-dione

Systemtic Name: 2-[8-(2-chloranyl-4-methyl-3-phenyl-phenoxy)octyl]isoindole-1,3-dione Openeye Name: 2-[8-(2-chloro-4-methyl-3-phenyl-phenoxy)octyl]isoindoline-1,3-dione CAS Name: 2-[8-(2-chloro-4-methyl-3-phenylphenoxy)octyl]isoindole-1,3-dione IUPAC Name: 2-[8-(2-chloro-4-methyl-3-phenylphenoxy)octyl]isoindole-1,3-dione Traditional Name: 2-[8-(2-chloro-4-methyl-3-phenyl-phenoxy)octyl]isoindoline-1,3-quinone Formula: C29H30ClNO3 MolecularWeight: 476.0064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)OCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(C=C1)OCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

InChI

InChI=1S/C29H30ClNO3/c1-21-17-18-25(27(30)26(21)22-13-7-6-8-14-22)34-20-12-5-3-2-4-11-19-31-28(32)23-15-9-10-16-24(23)29(31)33/h6-10,13-18H,2-5,11-12,19-20H2,1H3