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

Systemtic Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone Openeye Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone CAS Name: 1-[4-(9-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]ethanone IUPAC Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]ethanone Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3/c1-14-13-23(10-11-24(14)15(2)25)21-17-9-8-16(26-3)12-20(17)27-19-7-5-4-6-18(19)22-21/h4-9,12,14H,10-11,13H2,1-3H3