7-[(S)-[(4-nitrophenyl)amino]-pyridin-2-yl-methyl]quinolin-8-olate

Systemtic Name: 7-[(S)-[(4-nitrophenyl)amino]-pyridin-2-yl-methyl]quinolin-8-olate Openeye Name: 7-[(S)-(4-nitroanilino)-(2-pyridyl)methyl]quinolin-8-olate CAS Name: 7-[(S)-(4-nitroanilino)-(2-pyridinyl)methyl]-8-quinolinolate IUPAC Name: 7-[(S)-(4-nitroanilino)-pyridin-2-ylmethyl]quinolin-8-olate Traditional Name: 7-[(S)-(4-nitroanilino)-(2-pyridyl)methyl]quinolin-8-olate Formula: C21H15N4O3- MolecularWeight: 371.3688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(C2=C(C3=C(C=CC=N3)C=C2)[O-])NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)[C@H](C2=C(C3=C(C=CC=N3)C=C2)[O-])NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O3/c26-21-17(11-6-14-4-3-13-23-19(14)21)20(18-5-1-2-12-22-18)24-15-7-9-16(10-8-15)25(27)28/h1-13,20,24,26H/p-1/t20-/m0/s1