5-chloranyl-6-[(1S)-1-phenylethoxy]pyridine-3-carboxylate

Systemtic Name: 5-chloranyl-6-[(1S)-1-phenylethoxy]pyridine-3-carboxylate Openeye Name: 5-chloro-6-[(1S)-1-phenylethoxy]pyridine-3-carboxylate CAS Name: 5-chloro-6-[(1S)-1-phenylethoxy]-3-pyridinecarboxylate IUPAC Name: 5-chloro-6-[(1S)-1-phenylethoxy]pyridine-3-carboxylate Traditional Name: 5-chloro-6-[(1S)-1-phenylethoxy]nicotinate Formula: C14H11ClNO3- MolecularWeight: 276.69504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=N2)C(=O)[O-])Cl

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)OC2=C(C=C(C=N2)C(=O)[O-])Cl

InChI

InChI=1S/C14H12ClNO3/c1-9(10-5-3-2-4-6-10)19-13-12(15)7-11(8-16-13)14(17)18/h2-9H,1H3,(H,17,18)/p-1/t9-/m0/s1