4-benzo[b][1,4]benzoxazepin-6-yl-N-(4-methoxyphenyl)-2-methyl-piperazine-1-carboxamide

Systemtic Name: 4-benzo[b][1,4]benzoxazepin-6-yl-N-(4-methoxyphenyl)-2-methyl-piperazine-1-carboxamide Openeye Name: 4-benzo[b][1,4]benzoxazepin-6-yl-N-(4-methoxyphenyl)-2-methyl-piperazine-1-carboxamide CAS Name: 4-(6-benzo[b][1,4]benzoxazepinyl)-N-(4-methoxyphenyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-benzo[b][1,4]benzoxazepin-6-yl-N-(4-methoxyphenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-benzo[b][1,4]benzoxazepin-6-yl-N-(4-methoxyphenyl)-2-methyl-piperazine-1-carboxamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)OC)C3=NC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)OC)C3=NC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C26H26N4O3/c1-18-17-29(15-16-30(18)26(31)27-19-11-13-20(32-2)14-12-19)25-21-7-3-5-9-23(21)33-24-10-6-4-8-22(24)28-25/h3-14,18H,15-17H2,1-2H3,(H,27,31)