diethyl 4-(4-dimethylaminophenyl)-2,6-dimethyl-pyridine-3,5-dicarboxylate; iodanylmethane

Systemtic Name: diethyl 4-(4-dimethylaminophenyl)-2,6-dimethyl-pyridine-3,5-dicarboxylate; iodanylmethane Openeye Name: diethyl 4-(4-dimethylaminophenyl)-2,6-dimethyl-pyridine-3,5-dicarboxylate; iodomethane CAS Name: 4-(4-dimethylaminophenyl)-2,6-dimethylpyridine-3,5-dicarboxylic acid diethyl ester; iodomethane IUPAC Name: diethyl 4-(4-dimethylaminophenyl)-2,6-dimethylpyridine-3,5-dicarboxylate; iodomethane Traditional Name: 4-(4-dimethylaminophenyl)-2,6-dimethyl-pyridine-3,5-dicarboxylic acid diethyl ester; iodomethane Formula: C22H29IN2O4 MolecularWeight: 512.38113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1C2=CC=C(C=C2)N(C)C)C(=O)OCC)C)C.CI

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1C2=CC=C(C=C2)N(C)C)C(=O)OCC)C)C.CI

InChI

InChI=1S/C21H26N2O4.CH3I/c1-7-26-20(24)17-13(3)22-14(4)18(21(25)27-8-2)19(17)15-9-11-16(12-10-15)23(5)6;1-2/h9-12H,7-8H2,1-6H3;1H3