2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid Openeye Name: 2-[(1-isopropyl-4-piperidyl)carbamoyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid CAS Name: 2-[oxo-[(1-propan-2-yl-4-piperidinyl)amino]methyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid IUPAC Name: 2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid Traditional Name: 2-[(1-isopropyl-4-piperidyl)carbamoyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)NC(=O)C2=CC3=CC(=CN=C3N2)C(=O)O

Isomeric SMILES

CC(C)N1CCC(CC1)NC(=O)C2=CC3=CC(=CN=C3N2)C(=O)O

InChI

InChI=1S/C17H22N4O3/c1-10(2)21-5-3-13(4-6-21)19-16(22)14-8-11-7-12(17(23)24)9-18-15(11)20-14/h7-10,13H,3-6H2,1-2H3,(H,18,20)(H,19,22)(H,23,24)