4-(2-oxidanylidene-3-prop-2-enyl-1,3-diazinan-1-yl)benzoic acid

Systemtic Name: 4-(2-oxidanylidene-3-prop-2-enyl-1,3-diazinan-1-yl)benzoic acid Openeye Name: 4-(3-allyl-2-oxo-hexahydropyrimidin-1-yl)benzoic acid CAS Name: 4-(2-oxo-3-prop-2-enyl-1,3-diazinan-1-yl)benzoic acid IUPAC Name: 4-(2-oxo-3-prop-2-enyl-1,3-diazinan-1-yl)benzoic acid Traditional Name: 4-(3-allyl-2-keto-hexahydropyrimidin-1-yl)benzoic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCCN(C1=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C=CCN1CCCN(C1=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-2-8-15-9-3-10-16(14(15)19)12-6-4-11(5-7-12)13(17)18/h2,4-7H,1,3,8-10H2,(H,17,18)