2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-aniline

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-aniline Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-aniline CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methylaniline IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methylaniline Traditional Name: [2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-phenyl]amine Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N)S(=O)(=O)N2CCC3CCCCC3C2

Isomeric SMILES

CC1=C(C(=CC=C1)N)S(=O)(=O)N2CCC3CCCCC3C2

InChI

InChI=1S/C16H24N2O2S/c1-12-5-4-8-15(17)16(12)21(19,20)18-10-9-13-6-2-3-7-14(13)11-18/h4-5,8,13-14H,2-3,6-7,9-11,17H2,1H3