2-methyl-2-[3-methyl-2-(4-nitrophenyl)-1-propyl-indol-5-yl]oxy-propanoic acid

Systemtic Name: 2-methyl-2-[3-methyl-2-(4-nitrophenyl)-1-propyl-indol-5-yl]oxy-propanoic acid Openeye Name: 2-methyl-2-[3-methyl-2-(4-nitrophenyl)-1-propyl-indol-5-yl]oxy-propanoic acid CAS Name: 2-methyl-2-[[3-methyl-2-(4-nitrophenyl)-1-propyl-5-indolyl]oxy]propanoic acid IUPAC Name: 2-methyl-2-[3-methyl-2-(4-nitrophenyl)-1-propylindol-5-yl]oxypropanoic acid Traditional Name: 2-methyl-2-[3-methyl-2-(4-nitrophenyl)-1-propyl-indol-5-yl]oxy-propionic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)OC(C)(C)C(=O)O)C(=C1C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)OC(C)(C)C(=O)O)C(=C1C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N2O5/c1-5-12-23-19-11-10-17(29-22(3,4)21(25)26)13-18(19)14(2)20(23)15-6-8-16(9-7-15)24(27)28/h6-11,13H,5,12H2,1-4H3,(H,25,26)