[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] pyridine-4-carboxylate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] pyridine-4-carboxylate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=NC=C3

Isomeric SMILES

C1CC1NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=NC=C3

InChI

InChI=1S/C17H16N2O3/c20-16(19-14-6-7-14)15(12-4-2-1-3-5-12)22-17(21)13-8-10-18-11-9-13/h1-5,8-11,14-15H,6-7H2,(H,19,20)/t15-/m1/s1