1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-(10-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1,4-diazepan-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one Formula: C24H29N3O3 MolecularWeight: 407.50536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=CC=C4OC

Isomeric SMILES

CC(C)CC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=CC=C4OC

InChI

InChI=1S/C24H29N3O3/c1-17(2)16-22(28)26-12-7-13-27(15-14-26)24-18-8-6-11-21(29-3)23(18)30-20-10-5-4-9-19(20)25-24/h4-6,8-11,17H,7,12-16H2,1-3H3