diethyl 1-(benzimidazol-1-ylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 1-(benzimidazol-1-ylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 1-(benzimidazol-1-ylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(1-benzimidazolylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(benzimidazol-1-ylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(benzimidazol-1-ylmethyl)-2,6-dimethyl-4-phenyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC=CC=C2)C(=O)OCC)C)CN3C=NC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC=CC=C2)C(=O)OCC)C)CN3C=NC4=CC=CC=C43)C

InChI

InChI=1S/C27H29N3O4/c1-5-33-26(31)23-18(3)30(17-29-16-28-21-14-10-11-15-22(21)29)19(4)24(27(32)34-6-2)25(23)20-12-8-7-9-13-20/h7-16,25H,5-6,17H2,1-4H3