2-methyl-5-methylsulfonyl-N-octan-2-yl-aniline

Systemtic Name: 2-methyl-5-methylsulfonyl-N-octan-2-yl-aniline Openeye Name: 2-methyl-N-(1-methylheptyl)-5-methylsulfonyl-aniline CAS Name: 2-methyl-5-methylsulfonyl-N-octan-2-ylaniline IUPAC Name: 2-methyl-5-methylsulfonyl-N-octan-2-ylaniline Traditional Name: (5-mesyl-2-methyl-phenyl)-(1-methylheptyl)amine Formula: C16H27NO2S MolecularWeight: 297.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=C(C=CC(=C1)S(=O)(=O)C)C

Isomeric SMILES

CCCCCCC(C)NC1=C(C=CC(=C1)S(=O)(=O)C)C

InChI

InChI=1S/C16H27NO2S/c1-5-6-7-8-9-14(3)17-16-12-15(20(4,18)19)11-10-13(16)2/h10-12,14,17H,5-9H2,1-4H3