N-cyclopropyl-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-cyclopropyl-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-benzyl-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-cyclopropyl-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-benzyl-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-benzyl-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4CC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4CC4)OC1

InChI

InChI=1S/C19H21NO4S/c21-25(22,17-9-10-18-19(13-17)24-12-4-11-23-18)20(16-7-8-16)14-15-5-2-1-3-6-15/h1-3,5-6,9-10,13,16H,4,7-8,11-12,14H2