2-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 2-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 2-[(Z)-1-(p-tolyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; 2-[(Z)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)prop-1-enyl]pyridine IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; 2-[(Z)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine Traditional Name: 2-[(Z)-1-(p-tolyl)-3-pyrrolidino-prop-1-enyl]pyridine citrate Formula: C25H27N2O7-3 MolecularWeight: 467.49108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CCN2CCCC2)C3=CC=CC=N3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C/CN2CCCC2)/C3=CC=CC=N3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C19H22N2.C6H8O7/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-3,6-12H,4-5,13-15H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3/b18-11-;