1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methyl-azepane

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methyl-azepane Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methyl-azepane CAS Name: 1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methylazepane IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methylazepane Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-4-ethoxy-4-methyl-azepane Formula: C19H31NO3S MolecularWeight: 353.51934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CCOC1(CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C19H31NO3S/c1-6-23-19(5)12-7-14-20(15-13-19)24(21,22)17-10-8-16(9-11-17)18(2,3)4/h8-11H,6-7,12-15H2,1-5H3