3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one

Systemtic Name: 3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one Openeye Name: 3-[1-(p-tolylsulfonyl)-4-piperidyl]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one CAS Name: 3-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one IUPAC Name: 3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-6,7,8,9-tetrahydrobenzo[7]annulen-5-one Traditional Name: 3-(1-tosyl-4-piperidyl)-6,7,8,9-tetrahydrobenzocyclohepten-5-one Formula: C23H27NO3S MolecularWeight: 397.53038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CC4=C(CCCCC4=O)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CC4=C(CCCCC4=O)C=C3

InChI

InChI=1S/C23H27NO3S/c1-17-6-10-21(11-7-17)28(26,27)24-14-12-18(13-15-24)20-9-8-19-4-2-3-5-23(25)22(19)16-20/h6-11,16,18H,2-5,12-15H2,1H3