5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolo[2,3-b]pyridine-3-carboxylic acid

Systemtic Name: 5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolo[2,3-b]pyridine-3-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-5-methyl-pyrrolo[2,3-b]pyridine-3-carboxylic acid CAS Name: 5-methyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolo[2,3-b]pyridinecarboxylic acid IUPAC Name: 5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolo[2,3-b]pyridine-3-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-5-methyl-pyrrolo[2,3-b]pyridine-3-carboxylic acid Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C(=CN2C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=CN=C2C(=C1)C(=CN2C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C14H16N2O4/c1-8-5-9-10(12(17)18)7-16(11(9)15-6-8)13(19)20-14(2,3)4/h5-7H,1-4H3,(H,17,18)