ethanedioic acid; propan-2-yl 6-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine-2-carboxylate

Systemtic Name: ethanedioic acid; propan-2-yl 6-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine-2-carboxylate Openeye Name: isopropyl 6-[(Z)-1-(p-tolyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine-2-carboxylate; oxalic acid CAS Name: 6-[(Z)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)prop-1-enyl]-2-pyridinecarboxylic acid propan-2-yl ester; oxalic acid IUPAC Name: oxalic acid; propan-2-yl 6-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine-2-carboxylate Traditional Name: oxalic acid; 6-[(Z)-1-(p-tolyl)-3-pyrrolidino-prop-1-enyl]picolinic acid isopropyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CCN2CCCC2)C3=NC(=CC=C3)C(=O)OC(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C/CN2CCCC2)/C3=NC(=CC=C3)C(=O)OC(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H28N2O2.C2H2O4/c1-17(2)27-23(26)22-8-6-7-21(24-22)20(13-16-25-14-4-5-15-25)19-11-9-18(3)10-12-19;3-1(4)2(5)6/h6-13,17H,4-5,14-16H2,1-3H3;(H,3,4)(H,5,6)/b20-13-;