3-(azepan-1-ylsulfonyl)-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-benzamide Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-11-6-7-12(14(15)17)10-13(11)20(18,19)16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3,(H2,15,17)