1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane

Systemtic Name: 1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane Openeye Name: 1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane CAS Name: 1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane IUPAC Name: 1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane Traditional Name: 1-(4-butoxyphenyl)sulfonyl-4-methyl-1,4-diazepane Formula: C16H26N2O3S MolecularWeight: 326.45424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C

InChI

InChI=1S/C16H26N2O3S/c1-3-4-14-21-15-6-8-16(9-7-15)22(19,20)18-11-5-10-17(2)12-13-18/h6-9H,3-5,10-14H2,1-2H3