N-[(4-dimethylaminophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[4-(dimethylamino)benzyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H22N2O4S/c1-20(2)15-6-4-14(5-7-15)13-19-25(21,22)16-8-9-17-18(12-16)24-11-3-10-23-17/h4-9,12,19H,3,10-11,13H2,1-2H3