6-chloranyl-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 6-chloranyl-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 2-(3-tert-butoxycarbonyl-4-phenyl-phenyl)-6-chloro-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 6-chloro-2-[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 6-chloro-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 2-(3-tert-butoxycarbonyl-4-phenyl-phenyl)-6-chloro-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid Formula: C28H25ClN2O4 MolecularWeight: 488.9621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)C2=NC(C(=C(N2)Cl)C(=O)O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)C2=NC(C(=C(N2)Cl)C(=O)O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H25ClN2O4/c1-28(2,3)35-27(34)21-16-19(14-15-20(21)17-10-6-4-7-11-17)25-30-23(18-12-8-5-9-13-18)22(26(32)33)24(29)31-25/h4-16,23H,1-3H3,(H,30,31)(H,32,33)