methyl (E)-4-[5-ethyl-6-naphthalen-1-ylcarbonyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]but-2-enoate

Systemtic Name: methyl (E)-4-[5-ethyl-6-naphthalen-1-ylcarbonyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]but-2-enoate Openeye Name: methyl (E)-4-[5-ethyl-6-(naphthalene-1-carbonyl)-2,4-dioxo-pyrimidin-1-yl]but-2-enoate CAS Name: (E)-4-[5-ethyl-6-[1-naphthalenyl(oxo)methyl]-2,4-dioxo-1-pyrimidinyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[5-ethyl-6-(naphthalene-1-carbonyl)-2,4-dioxopyrimidin-1-yl]but-2-enoate Traditional Name: (E)-4-[5-ethyl-2,4-diketo-6-(1-naphthoyl)pyrimidin-1-yl]but-2-enoic acid methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)CC=CC(=O)OC)C(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)C/C=C/C(=O)OC)C(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H20N2O5/c1-3-15-19(20(26)17-11-6-9-14-8-4-5-10-16(14)17)24(22(28)23-21(15)27)13-7-12-18(25)29-2/h4-12H,3,13H2,1-2H3,(H,23,27,28)/b12-7+