3-(azepan-1-ylsulfonyl)-2,4-dimethyl-aniline

Systemtic Name: 3-(azepan-1-ylsulfonyl)-2,4-dimethyl-aniline Openeye Name: 3-(azepan-1-ylsulfonyl)-2,4-dimethyl-aniline CAS Name: 3-(1-azepanylsulfonyl)-2,4-dimethylaniline IUPAC Name: 3-(azepan-1-ylsulfonyl)-2,4-dimethylaniline Traditional Name: [3-(azepan-1-ylsulfonyl)-2,4-dimethyl-phenyl]amine Formula: C14H22N2O2S MolecularWeight: 282.40168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)N)C)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC1=C(C(=C(C=C1)N)C)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C14H22N2O2S/c1-11-7-8-13(15)12(2)14(11)19(17,18)16-9-5-3-4-6-10-16/h7-8H,3-6,9-10,15H2,1-2H3