1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazino]-3-methyl-butan-1-one Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)OC

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)OC

InChI

InChI=1S/C23H27N3O3/c1-16(2)14-22(27)25-10-12-26(13-11-25)23-18-15-17(28-3)8-9-20(18)29-21-7-5-4-6-19(21)24-23/h4-9,15-16H,10-14H2,1-3H3