methyl 2-[2-nitro-4-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)iminomethyl]phenoxy]propanoate

Systemtic Name: methyl 2-[2-nitro-4-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)iminomethyl]phenoxy]propanoate Openeye Name: methyl 2-[2-nitro-4-[(4-oxo-2-phenyl-quinazolin-3-yl)iminomethyl]phenoxy]propanoate CAS Name: 2-[2-nitro-4-[(4-oxo-2-phenyl-3-quinazolinyl)iminomethyl]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[2-nitro-4-[(4-oxo-2-phenylquinazolin-3-yl)iminomethyl]phenoxy]propanoate Traditional Name: 2-[4-[(4-keto-2-phenyl-quinazolin-3-yl)iminomethyl]-2-nitro-phenoxy]propionic acid methyl ester Formula: C25H20N4O6 MolecularWeight: 472.4495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=C(C=C(C=C1)C=NN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)OC1=C(C=C(C=C1)C=NN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O6/c1-16(25(31)34-2)35-22-13-12-17(14-21(22)29(32)33)15-26-28-23(18-8-4-3-5-9-18)27-20-11-7-6-10-19(20)24(28)30/h3-16H,1-2H3