2-[(E)-1-(4-bromophenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine; ethanedioic acid

Systemtic Name: 2-[(E)-1-(4-bromophenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine; ethanedioic acid Openeye Name: 2-[(E)-1-(4-bromophenyl)-3-pyrrolidin-1-yl-prop-1-enyl]pyridine; oxalic acid CAS Name: 2-[(E)-1-(4-bromophenyl)-3-(1-pyrrolidinyl)prop-1-enyl]pyridine; oxalic acid IUPAC Name: 2-[(E)-1-(4-bromophenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine; oxalic acid Traditional Name: 2-[(E)-1-(4-bromophenyl)-3-pyrrolidino-prop-1-enyl]pyridine; oxalic acid Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC=C(C2=CC=C(C=C2)Br)C3=CC=CC=N3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)C/C=C(\C2=CC=C(C=C2)Br)/C3=CC=CC=N3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19BrN2.C2H2O4/c19-16-8-6-15(7-9-16)17(18-5-1-2-11-20-18)10-14-21-12-3-4-13-21;3-1(4)2(5)6/h1-2,5-11H,3-4,12-14H2;(H,3,4)(H,5,6)/b17-10+;