[1-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [1-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Openeye Name: [1-(2-bromo-4,5-dimethoxy-phenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone CAS Name: [1-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-4-piperidinyl]-(4-methoxyphenyl)methanone IUPAC Name: [1-(2-bromo-4,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Traditional Name: [1-(2-bromo-4,5-dimethoxy-phenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone Formula: C21H24BrNO6S MolecularWeight: 498.38736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

InChI

InChI=1S/C21H24BrNO6S/c1-27-16-6-4-14(5-7-16)21(24)15-8-10-23(11-9-15)30(25,26)20-13-19(29-3)18(28-2)12-17(20)22/h4-7,12-13,15H,8-11H2,1-3H3