8-azanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: 8-azanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: 8-amino-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: 8-amino-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: 8-amino-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: 8-amino-N-[2-[4-(2-methoxyphenyl)piperazino]ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C22H30N4O5S MolecularWeight: 462.5624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCNS(=O)(=O)C3=CC4=C(C=C3N)OCCCO4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCNS(=O)(=O)C3=CC4=C(C=C3N)OCCCO4

InChI

InChI=1S/C22H30N4O5S/c1-29-19-6-3-2-5-18(19)26-11-9-25(10-12-26)8-7-24-32(27,28)22-16-21-20(15-17(22)23)30-13-4-14-31-21/h2-3,5-6,15-16,24H,4,7-14,23H2,1H3