2-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-(8-methyl-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazino]propan-1-one Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)C(C)C

InChI

InChI=1S/C22H25N3O2/c1-15(2)22(26)25-12-10-24(11-13-25)21-17-14-16(3)8-9-19(17)27-20-7-5-4-6-18(20)23-21/h4-9,14-15H,10-13H2,1-3H3