1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitro-phenoxy)ethanone Openeye Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitro-phenoxy)ethanone CAS Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitrophenoxy)ethanone IUPAC Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitrophenoxy)ethanone Traditional Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(5-methyl-2-nitro-phenoxy)ethanone Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42

InChI

InChI=1S/C23H20N2O4/c1-16-10-13-21(25(27)28)22(14-16)29-15-23(26)24-19-8-4-2-6-17(19)11-12-18-7-3-5-9-20(18)24/h2-10,13-14H,11-12,15H2,1H3