2-methyl-2-[2-(4-nitrophenyl)-1-propyl-indol-6-yl]oxy-propanoic acid

Systemtic Name: 2-methyl-2-[2-(4-nitrophenyl)-1-propyl-indol-6-yl]oxy-propanoic acid Openeye Name: 2-methyl-2-[2-(4-nitrophenyl)-1-propyl-indol-6-yl]oxy-propanoic acid CAS Name: 2-methyl-2-[[2-(4-nitrophenyl)-1-propyl-6-indolyl]oxy]propanoic acid IUPAC Name: 2-methyl-2-[2-(4-nitrophenyl)-1-propylindol-6-yl]oxypropanoic acid Traditional Name: 2-methyl-2-[2-(4-nitrophenyl)-1-propyl-indol-6-yl]oxy-propionic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC2=C1C=C(C=C2)OC(C)(C)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=CC2=C1C=C(C=C2)OC(C)(C)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O5/c1-4-11-22-18(14-5-8-16(9-6-14)23(26)27)12-15-7-10-17(13-19(15)22)28-21(2,3)20(24)25/h5-10,12-13H,4,11H2,1-3H3,(H,24,25)