2-[4-[(2-ethyl-4-methyl-pyrrolo[2,3-b]pyridin-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(2-ethyl-4-methyl-pyrrolo[2,3-b]pyridin-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(2-ethyl-4-methyl-pyrrolo[2,3-b]pyridin-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(2-ethyl-4-methyl-1-pyrrolo[2,3-b]pyridinyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(2-ethyl-4-methylpyrrolo[2,3-b]pyridin-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(2-ethyl-4-methyl-pyrrolo[2,3-b]pyridin-1-yl)methyl]phenyl]benzoic acid Formula: C24H22N2O2 MolecularWeight: 370.44368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C

Isomeric SMILES

CCC1=CC2=C(C=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C

InChI

InChI=1S/C24H22N2O2/c1-3-19-14-22-16(2)12-13-25-23(22)26(19)15-17-8-10-18(11-9-17)20-6-4-5-7-21(20)24(27)28/h4-14H,3,15H2,1-2H3,(H,27,28)