2,4-diphenylpyrrolidin-1-ium; ethanedioate

Systemtic Name: 2,4-diphenylpyrrolidin-1-ium; ethanedioate Openeye Name: 2,4-diphenylpyrrolidin-1-ium; oxalate CAS Name: 2,4-diphenylpyrrolidin-1-ium; oxalate IUPAC Name: 2,4-diphenylpyrrolidin-1-ium; oxalate Traditional Name: 2,4-diphenylpyrrolidin-1-ium; oxalate Formula: C34H36N2O4 MolecularWeight: 536.66064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C2=CC=CC=C2)C3=CC=CC=C3.C1C(C[NH2+]C1C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1C(C[NH2+]C1C2=CC=CC=C2)C3=CC=CC=C3.C1C(C[NH2+]C1C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/2C16H17N.C2H2O4/c2*1-3-7-13(8-4-1)15-11-16(17-12-15)14-9-5-2-6-10-14;3-1(4)2(5)6/h2*1-10,15-17H,11-12H2;(H,3,4)(H,5,6)