2-[8-(4-chloranylphenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-dione

Systemtic Name: 2-[8-(4-chloranylphenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-dione Openeye Name: 2-[8-(4-chlorophenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-dione CAS Name: 2-[8-(4-chlorophenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-dione IUPAC Name: 2-[8-(4-chlorophenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-dione Traditional Name: 2-[8-(4-chlorophenoxy)octyl]-5,6-dimethoxy-2,3-dihydro-1H-indene-4,7-quinone Formula: C25H31ClO5 MolecularWeight: 446.96364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C2=C(C1=O)CC(C2)CCCCCCCCOC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=O)C2=C(C1=O)CC(C2)CCCCCCCCOC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C25H31ClO5/c1-29-24-22(27)20-15-17(16-21(20)23(28)25(24)30-2)9-7-5-3-4-6-8-14-31-19-12-10-18(26)11-13-19/h10-13,17H,3-9,14-16H2,1-2H3