methyl 4-[(E)-3-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenoxy]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenoxy]prop-1-enyl]benzoic acid methyl ester Formula: C28H23N3O4 MolecularWeight: 465.49992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C=CC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)/C=C/C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H23N3O4/c1-19-29-25(21-6-4-3-5-7-21)18-26(30-19)31-23-13-15-24(16-14-23)35-27(32)17-10-20-8-11-22(12-9-20)28(33)34-2/h3-18H,1-2H3,(H,29,30,31)/b17-10+