3-[2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]propanoic acid

Systemtic Name: 3-[2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]propanoic acid Openeye Name: 3-[2-[(E)-2-(3-nitrophenyl)vinyl]-4-oxo-quinazolin-3-yl]propanoic acid CAS Name: 3-[2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxo-3-quinazolinyl]propanoic acid IUPAC Name: 3-[2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxoquinazolin-3-yl]propanoic acid Traditional Name: 3-[4-keto-2-[(E)-2-(3-nitrophenyl)vinyl]quinazolin-3-yl]propionic acid Formula: C19H15N3O5 MolecularWeight: 365.3395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)C=CC3=CC(=CC=C3)[N+](=O)[O-])CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])CCC(=O)O

InChI

InChI=1S/C19H15N3O5/c23-18(24)10-11-21-17(20-16-7-2-1-6-15(16)19(21)25)9-8-13-4-3-5-14(12-13)22(26)27/h1-9,12H,10-11H2,(H,23,24)/b9-8+