1-(4-bromanyl-5-methyl-2-propan-2-yl-phenyl)sulfonylazepane

Systemtic Name: 1-(4-bromanyl-5-methyl-2-propan-2-yl-phenyl)sulfonylazepane Openeye Name: 1-(4-bromo-2-isopropyl-5-methyl-phenyl)sulfonylazepane CAS Name: 1-(4-bromo-5-methyl-2-propan-2-ylphenyl)sulfonylazepane IUPAC Name: 1-(4-bromo-5-methyl-2-propan-2-ylphenyl)sulfonylazepane Traditional Name: 1-(4-bromo-2-isopropyl-5-methyl-phenyl)sulfonylazepane Formula: C16H24BrNO2S MolecularWeight: 374.33626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C16H24BrNO2S/c1-12(2)14-11-15(17)13(3)10-16(14)21(19,20)18-8-6-4-5-7-9-18/h10-12H,4-9H2,1-3H3