ethyl 4-[[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-anilino]quinazoline-2-carboxylate CAS Name: 4-[3-(4-chloro-3-methylphenoxy)-5-nitroanilino]-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-chloro-3-methylphenoxy)-5-nitroanilino]quinazoline-2-carboxylate Traditional Name: 4-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-anilino]quinazoline-2-carboxylic acid ethyl ester Formula: C24H19ClN4O5 MolecularWeight: 478.88446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C24H19ClN4O5/c1-3-33-24(30)23-27-21-7-5-4-6-19(21)22(28-23)26-15-11-16(29(31)32)13-18(12-15)34-17-8-9-20(25)14(2)10-17/h4-13H,3H2,1-2H3,(H,26,27,28)