3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-aniline

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-aniline Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-aniline CAS Name: 3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methylaniline IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methylaniline Traditional Name: [3-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-phenyl]amine Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CC2=C(C(=CC=C2)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CC2=C(C(=CC=C2)N)C

InChI

InChI=1S/C16H19NO2S/c1-11-7-8-12(2)16(9-11)20(18,19)10-14-5-4-6-15(17)13(14)3/h4-9H,10,17H2,1-3H3