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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=CN(C2=O)C=CC(=O)O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=CN(C2=O)/C=C/C(=O)O

InChI

InChI=1S/C15H16N2O3/c1-2-3-4-11-5-6-13-12(9-11)15(20)17(10-16-13)8-7-14(18)19/h5-10H,2-4H2,1H3,(H,18,19)/b8-7+