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

Systemtic Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)OC)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H25NO5S/c1-14(2)20(15-5-7-16(24-3)8-6-15)21-27(22,23)17-9-10-18-19(13-17)26-12-4-11-25-18/h5-10,13-14,20-21H,4,11-12H2,1-3H3