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

Systemtic Name: [1-(5-bromanyl-2-ethoxy-phenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Openeye Name: [1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone CAS Name: [1-(5-bromo-2-ethoxyphenyl)sulfonyl-4-piperidinyl]-(4-methoxyphenyl)methanone IUPAC Name: [1-(5-bromo-2-ethoxyphenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Traditional Name: [1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone Formula: C21H24BrNO5S MolecularWeight: 482.38796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24BrNO5S/c1-3-28-19-9-6-17(22)14-20(19)29(25,26)23-12-10-16(11-13-23)21(24)15-4-7-18(27-2)8-5-15/h4-9,14,16H,3,10-13H2,1-2H3