[2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1-benzothiophen-3-yl]methyl 3-chloranylbenzoate

Systemtic Name: [2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1-benzothiophen-3-yl]methyl 3-chloranylbenzoate Openeye Name: [2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-4-oxo-5,7-dihydrobenzothiophen-3-yl]methyl 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-4-oxo-5,7-dihydro-1-benzothiophen-3-yl]methyl ester IUPAC Name: [2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-4-oxo-5,7-dihydro-1-benzothiophen-3-yl]methyl 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [4-keto-2-[(4-methoxyphenoxy)methyl]-6,6-dimethyl-5,7-dihydrobenzothiophen-3-yl]methyl ester Formula: C26H25ClO5S MolecularWeight: 484.9917

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=C(S2)COC3=CC=C(C=C3)OC)COC(=O)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=C(S2)COC3=CC=C(C=C3)OC)COC(=O)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C26H25ClO5S/c1-26(2)12-21(28)24-20(14-32-25(29)16-5-4-6-17(27)11-16)23(33-22(24)13-26)15-31-19-9-7-18(30-3)8-10-19/h4-11H,12-15H2,1-3H3