2-[[4-[(E)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)prop-2-enoyl]phenyl]amino]ethanoic acid

Systemtic Name: 2-[[4-[(E)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)prop-2-enoyl]phenyl]amino]ethanoic acid Openeye Name: 2-[4-[(E)-3-(4-oxo-3-phenyl-quinazolin-2-yl)prop-2-enoyl]anilino]acetic acid CAS Name: 2-[4-[(E)-1-oxo-3-(4-oxo-3-phenyl-2-quinazolinyl)prop-2-enyl]anilino]acetic acid IUPAC Name: 2-[4-[(E)-3-(4-oxo-3-phenylquinazolin-2-yl)prop-2-enoyl]anilino]acetic acid Traditional Name: 2-[4-[(E)-3-(4-keto-3-phenyl-quinazolin-2-yl)acryloyl]anilino]acetic acid Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC(=O)C4=CC=C(C=C4)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C(=O)C4=CC=C(C=C4)NCC(=O)O

InChI

InChI=1S/C25H19N3O4/c29-22(17-10-12-18(13-11-17)26-16-24(30)31)14-15-23-27-21-9-5-4-8-20(21)25(32)28(23)19-6-2-1-3-7-19/h1-15,26H,16H2,(H,30,31)/b15-14+