N-(4-chlorophenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide Openeye Name: N-(4-chlorophenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide CAS Name: N-(4-chlorophenyl)-2-nitro-4-benzo[b][1]benzoxepincarboxamide IUPAC Name: N-(4-chlorophenyl)-2-nitrobenzo[b][1]benzoxepine-4-carboxamide Traditional Name: N-(4-chlorophenyl)-2-nitro-benzo[b][1]benzoxepin-4-carboxamide Formula: C21H13ClN2O4 MolecularWeight: 392.79192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C(O2)C=C(C=C3C(=O)NC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C(O2)C=C(C=C3C(=O)NC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H13ClN2O4/c22-14-6-8-15(9-7-14)23-21(25)18-11-16(24(26)27)12-20-17(18)10-5-13-3-1-2-4-19(13)28-20/h1-12H,(H,23,25)