N-[6-(4-propan-2-ylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-8-yl]benzamide

Systemtic Name: N-[6-(4-propan-2-ylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-8-yl]benzamide Openeye Name: N-[6-(4-isopropylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-8-yl]benzamide CAS Name: N-[6-(4-propan-2-yl-1-piperazinyl)-8-benzo[b][1,4]benzoxazepinyl]benzamide IUPAC Name: N-[6-(4-propan-2-ylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-8-yl]benzamide Traditional Name: N-[6-(4-isopropylpiperazino)benzo[b][1,4]benzoxazepin-8-yl]benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)N1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2/c1-19(2)30-14-16-31(17-15-30)26-22-18-21(28-27(32)20-8-4-3-5-9-20)12-13-24(22)33-25-11-7-6-10-23(25)29-26/h3-13,18-19H,14-17H2,1-2H3,(H,28,32)