[4-(2-ethylbutoxy)-3-nitro-phenyl] 3-(1H-indol-5-yl)propanoate

Systemtic Name: [4-(2-ethylbutoxy)-3-nitro-phenyl] 3-(1H-indol-5-yl)propanoate Openeye Name: [4-(2-ethylbutoxy)-3-nitro-phenyl] 3-(1H-indol-5-yl)propanoate CAS Name: 3-(1H-indol-5-yl)propanoic acid [4-(2-ethylbutoxy)-3-nitrophenyl] ester IUPAC Name: [4-(2-ethylbutoxy)-3-nitrophenyl] 3-(1H-indol-5-yl)propanoate Traditional Name: 3-(1H-indol-5-yl)propionic acid [4-(2-ethylbutoxy)-3-nitro-phenyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)COC1=C(C=C(C=C1)OC(=O)CCC2=CC3=C(C=C2)NC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)COC1=C(C=C(C=C1)OC(=O)CCC2=CC3=C(C=C2)NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H26N2O5/c1-3-16(4-2)15-29-22-9-7-19(14-21(22)25(27)28)30-23(26)10-6-17-5-8-20-18(13-17)11-12-24-20/h5,7-9,11-14,16,24H,3-4,6,10,15H2,1-2H3