5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxylic acid

Systemtic Name: 5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxylic acid Openeye Name: 5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxo-ethyl]phenyl]pyridine-3-carboxylic acid CAS Name: 5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]phenyl]-3-pyridinecarboxylic acid IUPAC Name: 5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]phenyl]pyridine-3-carboxylic acid Traditional Name: 5-[4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-keto-ethyl]phenyl]nicotinic acid Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC(=O)CC3=CC=C(C=C3)C4=CC(=CN=C4)C(=O)O

Isomeric SMILES

C1CC1C2=CC(=NN2)NC(=O)CC3=CC=C(C=C3)C4=CC(=CN=C4)C(=O)O

InChI

InChI=1S/C20H18N4O3/c25-19(22-18-9-17(23-24-18)14-5-6-14)7-12-1-3-13(4-2-12)15-8-16(20(26)27)11-21-10-15/h1-4,8-11,14H,5-7H2,(H,26,27)(H2,22,23,24,25)