3-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(10-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carbonyl]benzonitrile Formula: C26H22N4O3 MolecularWeight: 438.47788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)C5=CC=CC(=C5)C#N

Isomeric SMILES

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C26H22N4O3/c1-32-23-11-5-8-20-24(23)33-22-10-3-2-9-21(22)28-25(20)29-12-14-30(15-13-29)26(31)19-7-4-6-18(16-19)17-27/h2-11,16H,12-15H2,1H3