4-[2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]butanoic acid

Systemtic Name: 4-[2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]butanoic acid Openeye Name: 4-[2-[(E)-2-(3-ethoxyphenyl)vinyl]-4-oxo-quinazolin-3-yl]butanoic acid CAS Name: 4-[2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxo-3-quinazolinyl]butanoic acid IUPAC Name: 4-[2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxoquinazolin-3-yl]butanoic acid Traditional Name: 4-[4-keto-2-[(E)-2-m-phenetylvinyl]quinazolin-3-yl]butyric acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C=CC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2CCCC(=O)O

InChI

InChI=1S/C22H22N2O4/c1-2-28-17-8-5-7-16(15-17)12-13-20-23-19-10-4-3-9-18(19)22(27)24(20)14-6-11-21(25)26/h3-5,7-10,12-13,15H,2,6,11,14H2,1H3,(H,25,26)/b13-12+