1-[3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]-1-piperidyl]-2-methyl-propan-1-one CAS Name: 1-[3-[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-methyl-1-propanone IUPAC Name: 1-[3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]piperidin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]piperidino]-2-methyl-propan-1-one Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H31N3O5S/c1-16(2)20(25)23-10-4-5-17(15-23)21(26)22-11-13-24(14-12-22)30(27,28)19-8-6-18(29-3)7-9-19/h6-9,16-17H,4-5,10-15H2,1-3H3