4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-N-oxidanidyl-cyclohexane-1-carboxamide

Systemtic Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-N-oxidanidyl-cyclohexane-1-carboxamide Openeye Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-N-oxido-cyclohexanecarboxamide CAS Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-N-oxido-1-cyclohexanecarboxamide IUPAC Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-N-oxidocyclohexane-1-carboxamide Traditional Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(p-anisyl)amino]methyl]-N-oxido-cyclohexanecarboxamide Formula: C24H29N2O7S- MolecularWeight: 489.56126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2CCC(CC2)C(=O)N[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2CCC(CC2)C(=O)N[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H29N2O7S/c1-31-20-8-4-18(5-9-20)16-26(15-17-2-6-19(7-3-17)24(27)25-28)34(29,30)21-10-11-22-23(14-21)33-13-12-32-22/h4-5,8-11,14,17,19H,2-3,6-7,12-13,15-16H2,1H3,(H-,25,27,28)/q-1