cadmium; 7-[[(3-nitrophenyl)amino]-phenyl-methyl]quinolin-8-ol

Systemtic Name: cadmium; 7-[[(3-nitrophenyl)amino]-phenyl-methyl]quinolin-8-ol Openeye Name: cadmium; 7-[(3-nitroanilino)-phenyl-methyl]quinolin-8-ol CAS Name: cadmium; 7-[(3-nitroanilino)-phenylmethyl]-8-quinolinol IUPAC Name: cadmium; 7-[(3-nitroanilino)-phenylmethyl]quinolin-8-ol Traditional Name: cadmium; 7-[(3-nitroanilino)-phenyl-methyl]quinolin-8-ol Formula: C44H34CdN6O6 MolecularWeight: 855.18836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C22H17N3O3.Cd/c2*26-22-19(12-11-16-8-5-13-23-21(16)22)20(15-6-2-1-3-7-15)24-17-9-4-10-18(14-17)25(27)28;/h2*1-14,20,24,26H;