(3R)-2-[3,5-bis(chloranyl)pyridin-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: (3R)-2-[3,5-bis(chloranyl)pyridin-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: (3R)-2-(3,5-dichloro-2-pyridyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-(3,5-dichloro-2-pyridinyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate IUPAC Name: (3R)-2-(3,5-dichloropyridin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-(3,5-dichloro-2-pyridyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Formula: C15H11Cl2N2O2- MolecularWeight: 322.16604

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C3=C(C=C(C=N3)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1[C@@H](N(CC2=CC=CC=C21)C3=C(C=C(C=N3)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C15H12Cl2N2O2/c16-11-6-12(17)14(18-7-11)19-8-10-4-2-1-3-9(10)5-13(19)15(20)21/h1-4,6-7,13H,5,8H2,(H,20,21)/p-1/t13-/m1/s1