[4-(4-methoxyphenyl)piperazin-1-yl]-[(3S)-1-methylsulfonylpiperidin-3-yl]methanone

Systemtic Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[(3S)-1-methylsulfonylpiperidin-3-yl]methanone Openeye Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[(3S)-1-methylsulfonyl-3-piperidyl]methanone CAS Name: [4-(4-methoxyphenyl)-1-piperazinyl]-[(3S)-1-methylsulfonyl-3-piperidinyl]methanone IUPAC Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[(3S)-1-methylsulfonylpiperidin-3-yl]methanone Traditional Name: [(3S)-1-mesyl-3-piperidyl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)[C@H]3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C18H27N3O4S/c1-25-17-7-5-16(6-8-17)19-10-12-20(13-11-19)18(22)15-4-3-9-21(14-15)26(2,23)24/h5-8,15H,3-4,9-14H2,1-2H3/t15-/m0/s1