N-(3-fluorophenyl)-4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazine-1-carboxamide

Systemtic Name: N-(3-fluorophenyl)-4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazine-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazine-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-(10-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: N-(3-fluorophenyl)-4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazine-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazine-1-carboxamide Formula: C26H25FN4O3 MolecularWeight: 460.500103

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC(=CC=C2)F)C3=NC4=CC=CC=C4OC5=C3C=CC=C5OC

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC(=CC=C2)F)C3=NC4=CC=CC=C4OC5=C3C=CC=C5OC

InChI

InChI=1S/C26H25FN4O3/c1-17-16-30(13-14-31(17)26(32)28-19-8-5-7-18(27)15-19)25-20-9-6-12-23(33-2)24(20)34-22-11-4-3-10-21(22)29-25/h3-12,15,17H,13-14,16H2,1-2H3,(H,28,32)