bis(3-nitro-4-phenylmethoxy-phenyl)methanone

Systemtic Name: bis(3-nitro-4-phenylmethoxy-phenyl)methanone Openeye Name: bis(4-benzyloxy-3-nitro-phenyl)methanone CAS Name: bis(3-nitro-4-phenylmethoxyphenyl)methanone IUPAC Name: bis(3-nitro-4-phenylmethoxyphenyl)methanone Traditional Name: bis(4-benzoxy-3-nitro-phenyl)methanone Formula: C27H20N2O7 MolecularWeight: 484.4569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C27H20N2O7/c30-27(21-11-13-25(23(15-21)28(31)32)35-17-19-7-3-1-4-8-19)22-12-14-26(24(16-22)29(33)34)36-18-20-9-5-2-6-10-20/h1-16H,17-18H2