4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-N-methylsulfonyl-butanamide

Systemtic Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-N-methylsulfonyl-butanamide Openeye Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-N-methylsulfonyl-butanamide CAS Name: 4-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-N-methylsulfonylbutanamide IUPAC Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-N-methylsulfonylbutanamide Traditional Name: N-mesyl-4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazino]butyramide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)CCCC(=O)NS(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)CCCC(=O)NS(=O)(=O)C

InChI

InChI=1S/C23H28N4O5S/c1-31-17-9-10-20-18(16-17)23(24-19-6-3-4-7-21(19)32-20)27-14-12-26(13-15-27)11-5-8-22(28)25-33(2,29)30/h3-4,6-7,9-10,16H,5,8,11-15H2,1-2H3,(H,25,28)