1-benzothiophen-3-yl-[4-(2-chloroethyloxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone

Systemtic Name: 1-benzothiophen-3-yl-[4-(2-chloroethyloxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone Openeye Name: benzothiophen-3-yl-[4-(2-chloroethoxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone CAS Name: 1-benzothiophen-3-yl-[4-(2-chloroethoxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone IUPAC Name: 1-benzothiophen-3-yl-[4-(2-chloroethoxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone Traditional Name: benzothiophen-3-yl-[4-(2-chloroethoxy)-2-methoxy-6-(3-methylcyclohexyl)phenyl]methanone Formula: C25H27ClO3S MolecularWeight: 442.99808

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)C2=CC(=CC(=C2C(=O)C3=CSC4=CC=CC=C43)OC)OCCCl

Isomeric SMILES

CC1CCCC(C1)C2=CC(=CC(=C2C(=O)C3=CSC4=CC=CC=C43)OC)OCCCl

InChI

InChI=1S/C25H27ClO3S/c1-16-6-5-7-17(12-16)20-13-18(29-11-10-26)14-22(28-2)24(20)25(27)21-15-30-23-9-4-3-8-19(21)23/h3-4,8-9,13-17H,5-7,10-12H2,1-2H3