(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate CAS Name: 3-(3-methoxyphenyl)-2-phenyl-2-propenoic acid (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3-methoxyphenyl)-2-phenylprop-2-enoate Traditional Name: 3-(3-methoxyphenyl)-2-phenyl-acrylic acid (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C25H19BrN2O4 MolecularWeight: 491.33336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C2=CC=CC=C2)C(=O)OCC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

COC1=CC=CC(=C1)C=C(C2=CC=CC=C2)C(=O)OCC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C25H19BrN2O4/c1-31-21-9-5-6-17(12-21)13-22(18-7-3-2-4-8-18)25(30)32-16-20-14-24(29)28-15-19(26)10-11-23(28)27-20/h2-15H,16H2,1H3