2-methoxy-1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone Openeye Name: 2-methoxy-1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone CAS Name: 2-methoxy-1-[4-(9-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]ethanone IUPAC Name: 2-methoxy-1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]ethanone Traditional Name: 2-methoxy-1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]ethanone Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC)C2=NC3=CC=CC=C3OC4=C2C=CC(=C4)OC

Isomeric SMILES

CC1CN(CCN1C(=O)COC)C2=NC3=CC=CC=C3OC4=C2C=CC(=C4)OC

InChI

InChI=1S/C22H25N3O4/c1-15-13-24(10-11-25(15)21(26)14-27-2)22-17-9-8-16(28-3)12-20(17)29-19-7-5-4-6-18(19)23-22/h4-9,12,15H,10-11,13-14H2,1-3H3