1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-1,4-diazepane Openeye Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-1,4-diazepane CAS Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-1,4-diazepane Formula: C13H19BrN2O3S MolecularWeight: 363.27056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCNCC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCNCC2

InChI

InChI=1S/C13H19BrN2O3S/c1-2-19-12-5-4-11(14)10-13(12)20(17,18)16-8-3-6-15-7-9-16/h4-5,10,15H,2-3,6-9H2,1H3