[3-(3-chloranyl-4-methoxy-phenyl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol

Systemtic Name: [3-(3-chloranyl-4-methoxy-phenyl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol Openeye Name: [3-(3-chloro-4-methoxy-phenyl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol CAS Name: [3-(3-chloro-4-methoxyphenyl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)-1-cyclopent-3-enyl]methanol IUPAC Name: [3-(3-chloro-4-methoxyphenyl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol Traditional Name: [3-(3-chloro-4-methoxy-phenyl)-4-(4-mesylphenyl)-1-methylol-cyclopent-3-en-1-yl]methanol Formula: C21H23ClO5S MolecularWeight: 422.92232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H23ClO5S/c1-27-20-8-5-15(9-19(20)22)18-11-21(12-23,13-24)10-17(18)14-3-6-16(7-4-14)28(2,25)26/h3-9,23-24H,10-13H2,1-2H3