[4-[furan-2-ylmethyl-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyl]amino]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[furan-2-ylmethyl-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyl]amino]phenyl] 3-nitrobenzoate Openeye Name: [4-[2-furylmethyl-[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[2-furanylmethyl-[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]phenyl] ester IUPAC Name: [4-[furan-2-ylmethyl-[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[2-furfuryl-[2-(4-ketoquinazolin-3-yl)acetyl]amino]phenyl] ester Formula: C28H20N4O7 MolecularWeight: 524.481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)N(CC3=CC=CO3)C4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)N(CC3=CC=CO3)C4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H20N4O7/c33-26(17-30-18-29-25-9-2-1-8-24(25)27(30)34)31(16-23-7-4-14-38-23)20-10-12-22(13-11-20)39-28(35)19-5-3-6-21(15-19)32(36)37/h1-15,18H,16-17H2