ethyl (E)-3-[4-chloranyl-2,6-bis(oxidanylidene)-1,3-diphenyl-pyrimidin-5-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-chloranyl-2,6-bis(oxidanylidene)-1,3-diphenyl-pyrimidin-5-yl]prop-2-enoate Openeye Name: ethyl (E)-3-(4-chloro-2,6-dioxo-1,3-diphenyl-pyrimidin-5-yl)prop-2-enoate CAS Name: (E)-3-(4-chloro-2,6-dioxo-1,3-diphenyl-5-pyrimidinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-chloro-2,6-dioxo-1,3-diphenylpyrimidin-5-yl)prop-2-enoate Traditional Name: (E)-3-(4-chloro-2,6-diketo-1,3-diphenyl-pyrimidin-5-yl)acrylic acid ethyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)/C=C/C1=C(N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H17ClN2O4/c1-2-28-18(25)14-13-17-19(22)23(15-9-5-3-6-10-15)21(27)24(20(17)26)16-11-7-4-8-12-16/h3-14H,2H2,1H3/b14-13+