dimethyl 1-cyclopentyl-4-(4-phenylmethoxyphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-cyclopentyl-4-(4-phenylmethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(4-benzyloxyphenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylate CAS Name: 1-cyclopentyl-4-(4-phenylmethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-cyclopentyl-4-(4-phenylmethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(4-benzoxyphenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OC)C4CCCC4

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OC)C4CCCC4

InChI

InChI=1S/C27H29NO5/c1-31-26(29)23-16-28(21-10-6-7-11-21)17-24(27(30)32-2)25(23)20-12-14-22(15-13-20)33-18-19-8-4-3-5-9-19/h3-5,8-9,12-17,21,25H,6-7,10-11,18H2,1-2H3