10-methoxy-6-[4-(phenylsulfonyl)piperazin-1-yl]benzo[b][1,4]benzoxazepine

Systemtic Name: 10-methoxy-6-[4-(phenylsulfonyl)piperazin-1-yl]benzo[b][1,4]benzoxazepine Openeye Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-10-methoxy-benzo[b][1,4]benzoxazepine CAS Name: 6-[4-(benzenesulfonyl)-1-piperazinyl]-10-methoxybenzo[b][1,4]benzoxazepine IUPAC Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-10-methoxybenzo[b][1,4]benzoxazepine Traditional Name: 6-(4-besylpiperazino)-10-methoxy-benzo[b][1,4]benzoxazepine Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H23N3O4S/c1-30-22-13-7-10-19-23(22)31-21-12-6-5-11-20(21)25-24(19)26-14-16-27(17-15-26)32(28,29)18-8-3-2-4-9-18/h2-13H,14-17H2,1H3