1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-(9-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1,4-diazepan-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(9-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=CC(=C4)OC

Isomeric SMILES

CC(C)C(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=CC(=C4)OC

InChI

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