2-[2-methyl-4-(pyridin-4-ylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-4-(pyridin-4-ylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethanoic acid Openeye Name: 2-[2-methyl-4-(4-pyridylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid CAS Name: 2-[2-methyl-4-(pyridin-4-ylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid IUPAC Name: 2-[2-methyl-4-(pyridin-4-ylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid Traditional Name: 2-[2-methyl-4-(4-pyridylmethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CN=C2N1)CC3=CC=NC=C3)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(C=CN=C2N1)CC3=CC=NC=C3)CC(=O)O

InChI

InChI=1S/C16H15N3O2/c1-10-13(9-14(20)21)15-12(4-7-18-16(15)19-10)8-11-2-5-17-6-3-11/h2-7H,8-9H2,1H3,(H,18,19)(H,20,21)