N-[(3S)-2-oxidanylideneazepan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C15H20N2O5S MolecularWeight: 340.3947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H20N2O5S/c18-15-12(4-1-2-7-16-15)17-23(19,20)11-5-6-13-14(10-11)22-9-3-8-21-13/h5-6,10,12,17H,1-4,7-9H2,(H,16,18)/t12-/m0/s1