2-[4-methyl-4-(3-methylphenyl)sulfonyl-pentyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[4-methyl-4-(3-methylphenyl)sulfonyl-pentyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-methyl-4-(m-tolylsulfonyl)pentyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-methyl-4-(3-methylphenyl)sulfonylpentyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-methyl-4-(3-methylphenyl)sulfonylpentyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-methyl-4-(m-tolylsulfonyl)pentyl]-3,4-dihydro-1H-isoquinoline Formula: C22H29NO2S MolecularWeight: 371.53616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C(C)(C)CCCN2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C(C)(C)CCCN2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H29NO2S/c1-18-8-6-11-21(16-18)26(24,25)22(2,3)13-7-14-23-15-12-19-9-4-5-10-20(19)17-23/h4-6,8-11,16H,7,12-15,17H2,1-3H3