4-[2-[3,5-bis(chloranyl)-2-[(6-ethyl-2,3-dihydroindol-1-yl)methyl]-6-oxidanylidene-pyridin-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3,5-bis(chloranyl)-2-[(6-ethyl-2,3-dihydroindol-1-yl)methyl]-6-oxidanylidene-pyridin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[3,5-dichloro-2-[(6-ethylindolin-1-yl)methyl]-6-oxo-1-pyridyl]ethyl]benzoic acid CAS Name: 4-[2-[3,5-dichloro-2-[(6-ethyl-2,3-dihydroindol-1-yl)methyl]-6-oxo-1-pyridinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[3,5-dichloro-2-[(6-ethyl-2,3-dihydroindol-1-yl)methyl]-6-oxopyridin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[3,5-dichloro-2-[(6-ethylindolin-1-yl)methyl]-6-keto-1-pyridyl]ethyl]benzoic acid Formula: C25H24Cl2N2O3 MolecularWeight: 471.37566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(CCN2CC3=C(C=C(C(=O)N3CCC4=CC=C(C=C4)C(=O)O)Cl)Cl)C=C1

Isomeric SMILES

CCC1=CC2=C(CCN2CC3=C(C=C(C(=O)N3CCC4=CC=C(C=C4)C(=O)O)Cl)Cl)C=C1

InChI

InChI=1S/C25H24Cl2N2O3/c1-2-16-3-6-18-10-11-28(22(18)13-16)15-23-20(26)14-21(27)24(30)29(23)12-9-17-4-7-19(8-5-17)25(31)32/h3-8,13-14H,2,9-12,15H2,1H3,(H,31,32)