2-[2-methyl-1-[4-[2-(3-nitrophenyl)ethoxy]phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-[2-(3-nitrophenyl)ethoxy]phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[4-[2-(3-nitrophenyl)ethoxy]benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[[4-[2-(3-nitrophenyl)ethoxy]phenyl]-oxomethyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-[2-(3-nitrophenyl)ethoxy]benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[4-[2-(3-nitrophenyl)ethoxy]benzoyl]indol-4-yl]acetic acid Formula: C26H22N2O6 MolecularWeight: 458.46268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC(=CC=C4)[N+](=O)[O-])CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC(=CC=C4)[N+](=O)[O-])CC(=O)O

InChI

InChI=1S/C26H22N2O6/c1-17-14-23-20(16-25(29)30)5-3-7-24(23)27(17)26(31)19-8-10-22(11-9-19)34-13-12-18-4-2-6-21(15-18)28(32)33/h2-11,14-15H,12-13,16H2,1H3,(H,29,30)