2-bromanyl-N-[2,6-di(propan-2-yl)phenyl]-4-nitro-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide

Systemtic Name: 2-bromanyl-N-[2,6-di(propan-2-yl)phenyl]-4-nitro-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Openeye Name: 2-bromo-N-(2,6-diisopropylphenyl)-4-nitro-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide CAS Name: 2-bromo-N-[2,6-di(propan-2-yl)phenyl]-4-nitro-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide IUPAC Name: 2-bromo-N-[2,6-di(propan-2-yl)phenyl]-4-nitro-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Traditional Name: 2-bromo-N-(2,6-diisopropylphenyl)-4-nitro-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide Formula: C27H27BrN2O4 MolecularWeight: 523.41828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2C3=CC=CC=C3COC4=C(C=C(C=C24)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2C3=CC=CC=C3COC4=C(C=C(C=C24)Br)[N+](=O)[O-]

InChI

InChI=1S/C27H27BrN2O4/c1-15(2)19-10-7-11-20(16(3)4)25(19)29-27(31)24-21-9-6-5-8-17(21)14-34-26-22(24)12-18(28)13-23(26)30(32)33/h5-13,15-16,24H,14H2,1-4H3,(H,29,31)