4-[1-[2,4,6-tris(oxidanylidene)-1-prop-2-enyl-1,3-diazinan-5-ylidene]ethylamino]benzoate

Systemtic Name: 4-[1-[2,4,6-tris(oxidanylidene)-1-prop-2-enyl-1,3-diazinan-5-ylidene]ethylamino]benzoate Openeye Name: 4-[1-(1-allyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)ethylamino]benzoate CAS Name: 4-[1-(2,4,6-trioxo-1-prop-2-enyl-1,3-diazinan-5-ylidene)ethylamino]benzoate IUPAC Name: 4-[1-(2,4,6-trioxo-1-prop-2-enyl-1,3-diazinan-5-ylidene)ethylamino]benzoate Traditional Name: 4-[1-(1-allyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)ethylamino]benzoate Formula: C16H14N3O5- MolecularWeight: 328.29946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)NC(=O)N(C1=O)CC=C)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC(=C1C(=O)NC(=O)N(C1=O)CC=C)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C16H15N3O5/c1-3-8-19-14(21)12(13(20)18-16(19)24)9(2)17-11-6-4-10(5-7-11)15(22)23/h3-7,17H,1,8H2,2H3,(H,22,23)(H,18,20,24)/p-1