[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-acetyloxybenzoate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-acetyloxybenzoate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-acetoxybenzoate CAS Name: 4-acetyloxybenzoic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 4-acetyloxybenzoate Traditional Name: 4-acetoxybenzoic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21N3O4/c1-17-27-24(19-6-4-3-5-7-19)16-25(28-17)29-21-10-14-23(15-11-21)33-26(31)20-8-12-22(13-9-20)32-18(2)30/h3-16H,1-2H3,(H,27,28,29)