7-[(S)-[(3-chloranyl-4-methoxy-phenyl)amino]-pyridin-2-yl-methyl]quinolin-8-olate

Systemtic Name: 7-[(S)-[(3-chloranyl-4-methoxy-phenyl)amino]-pyridin-2-yl-methyl]quinolin-8-olate Openeye Name: 7-[(S)-(3-chloro-4-methoxy-anilino)-(2-pyridyl)methyl]quinolin-8-olate CAS Name: 7-[(S)-(3-chloro-4-methoxyanilino)-(2-pyridinyl)methyl]-8-quinolinolate IUPAC Name: 7-[(S)-(3-chloro-4-methoxyanilino)-pyridin-2-ylmethyl]quinolin-8-olate Traditional Name: 7-[(S)-(3-chloro-4-methoxy-anilino)-(2-pyridyl)methyl]quinolin-8-olate Formula: C22H17ClN3O2- MolecularWeight: 390.84228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)[O-])C4=CC=CC=N4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N[C@@H](C2=C(C3=C(C=CC=N3)C=C2)[O-])C4=CC=CC=N4)Cl

InChI

InChI=1S/C22H18ClN3O2/c1-28-19-10-8-15(13-17(19)23)26-21(18-6-2-3-11-24-18)16-9-7-14-5-4-12-25-20(14)22(16)27/h2-13,21,26-27H,1H3/p-1/t21-/m0/s1