[(R)-phenyl-[(1S,2S)-2-pyridin-3-ylcarbonylcyclopropyl]methyl] pyridine-3-carboxylate

Systemtic Name: [(R)-phenyl-[(1S,2S)-2-pyridin-3-ylcarbonylcyclopropyl]methyl] pyridine-3-carboxylate Openeye Name: [(R)-phenyl-[(1S,2S)-2-(pyridine-3-carbonyl)cyclopropyl]methyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [(R)-[(1S,2S)-2-[oxo(3-pyridinyl)methyl]cyclopropyl]-phenylmethyl] ester IUPAC Name: [(R)-phenyl-[(1S,2S)-2-(pyridine-3-carbonyl)cyclopropyl]methyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [(R)-[(1S,2S)-2-nicotinoylcyclopropyl]-phenyl-methyl] ester Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)C2=CN=CC=C2)C(C3=CC=CC=C3)OC(=O)C4=CN=CC=C4

Isomeric SMILES

C1[C@@H]([C@H]1C(=O)C2=CN=CC=C2)[C@H](C3=CC=CC=C3)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H18N2O3/c25-20(16-8-4-10-23-13-16)18-12-19(18)21(15-6-2-1-3-7-15)27-22(26)17-9-5-11-24-14-17/h1-11,13-14,18-19,21H,12H2/t18-,19-,21-/m0/s1