3-[[4-(1-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[4-(1-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]methyl]benzoic acid Openeye Name: 3-[[4-(1-isopropylpyrrolo[2,3-b]pyridin-3-yl)-1-piperidyl]methyl]benzoic acid CAS Name: 3-[[4-(1-propan-2-yl-3-pyrrolo[2,3-b]pyridinyl)-1-piperidinyl]methyl]benzoic acid IUPAC Name: 3-[[4-(1-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]methyl]benzoic acid Traditional Name: 3-[[4-(1-isopropylpyrrolo[2,3-b]pyridin-3-yl)piperidino]methyl]benzoic acid Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CC=C2)C3CCN(CC3)CC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CC=C2)C3CCN(CC3)CC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H27N3O2/c1-16(2)26-15-21(20-7-4-10-24-22(20)26)18-8-11-25(12-9-18)14-17-5-3-6-19(13-17)23(27)28/h3-7,10,13,15-16,18H,8-9,11-12,14H2,1-2H3,(H,27,28)