7-[(S)-[(4-chlorophenyl)amino]-pyridin-4-yl-methyl]quinolin-8-olate

Systemtic Name: 7-[(S)-[(4-chlorophenyl)amino]-pyridin-4-yl-methyl]quinolin-8-olate Openeye Name: 7-[(S)-(4-chloroanilino)-(4-pyridyl)methyl]quinolin-8-olate CAS Name: 7-[(S)-(4-chloroanilino)-pyridin-4-ylmethyl]-8-quinolinolate IUPAC Name: 7-[(S)-(4-chloroanilino)-pyridin-4-ylmethyl]quinolin-8-olate Traditional Name: 7-[(S)-(4-chloroanilino)-(4-pyridyl)methyl]quinolin-8-olate Formula: C21H15ClN3O- MolecularWeight: 360.8163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2)C(C3=CC=NC=C3)NC4=CC=C(C=C4)Cl)[O-])N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2)[C@H](C3=CC=NC=C3)NC4=CC=C(C=C4)Cl)[O-])N=C1

InChI

InChI=1S/C21H16ClN3O/c22-16-4-6-17(7-5-16)25-19(15-9-12-23-13-10-15)18-8-3-14-2-1-11-24-20(14)21(18)26/h1-13,19,25-26H/p-1/t19-/m0/s1