[1-[3-[1-(3-methylphenyl)sulfonylcyclobutyl]propyl]piperidin-4-yl]-phenyl-methanone

Systemtic Name: [1-[3-[1-(3-methylphenyl)sulfonylcyclobutyl]propyl]piperidin-4-yl]-phenyl-methanone Openeye Name: [1-[3-[1-(m-tolylsulfonyl)cyclobutyl]propyl]-4-piperidyl]-phenyl-methanone CAS Name: [1-[3-[1-(3-methylphenyl)sulfonylcyclobutyl]propyl]-4-piperidinyl]-phenylmethanone IUPAC Name: [1-[3-[1-(3-methylphenyl)sulfonylcyclobutyl]propyl]piperidin-4-yl]-phenylmethanone Traditional Name: [1-[3-[1-(m-tolylsulfonyl)cyclobutyl]propyl]-4-piperidyl]-phenyl-methanone Formula: C26H33NO3S MolecularWeight: 439.61012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C2(CCC2)CCCN3CCC(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C2(CCC2)CCCN3CCC(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H33NO3S/c1-21-8-5-11-24(20-21)31(29,30)26(14-6-15-26)16-7-17-27-18-12-23(13-19-27)25(28)22-9-3-2-4-10-22/h2-5,8-11,20,23H,6-7,12-19H2,1H3