N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide

Systemtic Name: N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide Openeye Name: N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide CAS Name: N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide IUPAC Name: N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide Traditional Name: N-butyl-N-(7-nitro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanesulfonamide Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCCOC2=C1C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CCCCN(C1CCCOC2=C1C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C15H22N2O5S/c1-3-4-9-16(23(2,20)21)14-6-5-10-22-15-8-7-12(17(18)19)11-13(14)15/h7-8,11,14H,3-6,9-10H2,1-2H3