cyclohexylmethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylate; ethanedioic acid

Systemtic Name: cyclohexylmethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylate; ethanedioic acid Openeye Name: cyclohexylmethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylate; oxalic acid CAS Name: 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylic acid cyclohexylmethyl ester; oxalic acid IUPAC Name: cyclohexylmethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylate; oxalic acid Traditional Name: 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylic acid cyclohexylmethyl ester; oxalic acid Formula: C23H31NO6 MolecularWeight: 417.49534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC=C(C(C1)C(=O)OCC2CCCCC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CC=C(C(C1)C(=O)OCC2CCCCC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO2.C2H2O4/c1-2-22-14-13-19(18-11-7-4-8-12-18)20(15-22)21(23)24-16-17-9-5-3-6-10-17;3-1(4)2(5)6/h4,7-8,11-13,17,20H,2-3,5-6,9-10,14-16H2,1H3;(H,3,4)(H,5,6)