N-(3-fluorophenyl)-4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-fluorophenyl)-4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-fluorophenyl)-4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazine-1-carboxamide Formula: C25H23FN4O3 MolecularWeight: 446.473523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C25H23FN4O3/c1-32-19-9-10-22-20(16-19)24(28-21-7-2-3-8-23(21)33-22)29-11-13-30(14-12-29)25(31)27-18-6-4-5-17(26)15-18/h2-10,15-16H,11-14H2,1H3,(H,27,31)