(E)-3-(6-butan-2-yl-4-oxidanylidene-quinazolin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(6-butan-2-yl-4-oxidanylidene-quinazolin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(4-oxo-6-sec-butyl-quinazolin-3-yl)prop-2-enoic acid CAS Name: (E)-3-(6-butan-2-yl-4-oxo-3-quinazolinyl)-2-propenoic acid IUPAC Name: (E)-3-(6-butan-2-yl-4-oxoquinazolin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(4-keto-6-sec-butyl-quinazolin-3-yl)acrylic acid Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)N=CN(C2=O)C=CC(=O)O

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)N=CN(C2=O)/C=C/C(=O)O

InChI

InChI=1S/C15H16N2O3/c1-3-10(2)11-4-5-13-12(8-11)15(20)17(9-16-13)7-6-14(18)19/h4-10H,3H2,1-2H3,(H,18,19)/b7-6+