3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-1-oxidanidyl-2-phenyl-indole

Systemtic Name: 3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-1-oxidanidyl-2-phenyl-indole Openeye Name: 3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-1-oxido-2-phenyl-indole CAS Name: 3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitroethyl]-1-oxido-2-phenylindole IUPAC Name: 3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitroethyl]-1-oxido-2-phenylindole Traditional Name: 3-[(1S)-1-(2,4-dimethoxyphenyl)-2-nitro-ethyl]-1-oxido-2-phenyl-indole Formula: C24H21N2O5- MolecularWeight: 417.43394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C[N+](=O)[O-])C2=C(N(C3=CC=CC=C32)[O-])C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@@H](C[N+](=O)[O-])C2=C(N(C3=CC=CC=C32)[O-])C4=CC=CC=C4)OC

InChI

InChI=1S/C24H21N2O5/c1-30-17-12-13-18(22(14-17)31-2)20(15-25(27)28)23-19-10-6-7-11-21(19)26(29)24(23)16-8-4-3-5-9-16/h3-14,20H,15H2,1-2H3/q-1/t20-/m1/s1