(2S)-1-(2,5-dimethoxyphenyl)-2-(diphenylmethyl)oxy-3-(2-methoxy-5-nitro-phenyl)propan-1-one

Systemtic Name: (2S)-1-(2,5-dimethoxyphenyl)-2-(diphenylmethyl)oxy-3-(2-methoxy-5-nitro-phenyl)propan-1-one Openeye Name: (2S)-2-benzhydryloxy-1-(2,5-dimethoxyphenyl)-3-(2-methoxy-5-nitro-phenyl)propan-1-one CAS Name: (2S)-1-(2,5-dimethoxyphenyl)-2-(diphenylmethyl)oxy-3-(2-methoxy-5-nitrophenyl)-1-propanone IUPAC Name: (2S)-2-benzhydryloxy-1-(2,5-dimethoxyphenyl)-3-(2-methoxy-5-nitrophenyl)propan-1-one Traditional Name: (2S)-2-benzhydryloxy-1-(2,5-dimethoxyphenyl)-3-(2-methoxy-5-nitro-phenyl)propan-1-one Formula: C31H29NO7 MolecularWeight: 527.56446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C(CC2=C(C=CC(=C2)[N+](=O)[O-])OC)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)[C@H](CC2=C(C=CC(=C2)[N+](=O)[O-])OC)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H29NO7/c1-36-25-15-17-28(38-3)26(20-25)30(33)29(19-23-18-24(32(34)35)14-16-27(23)37-2)39-31(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-18,20,29,31H,19H2,1-3H3/t29-/m0/s1