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

Systemtic Name: N-[(S)-(4-chlorophenyl)-cyclopropyl-methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(S)-(4-chlorophenyl)-cyclopropyl-methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[(S)-(4-chlorophenyl)-cyclopropylmethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(S)-(4-chlorophenyl)-cyclopropylmethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[(S)-(4-chlorophenyl)-cyclopropyl-methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC(C3CC3)C4=CC=C(C=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N[C@@H](C3CC3)C4=CC=C(C=C4)Cl)OC1

InChI

InChI=1S/C19H20ClNO4S/c20-15-6-4-14(5-7-15)19(13-2-3-13)21-26(22,23)16-8-9-17-18(12-16)25-11-1-10-24-17/h4-9,12-13,19,21H,1-3,10-11H2/t19-/m0/s1