ethanedioic acid; N-(4-methylphenyl)-2-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]ethanamide

Systemtic Name: ethanedioic acid; N-(4-methylphenyl)-2-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]ethanamide Openeye Name: 2-[(1-benzylpyrrolidin-3-yl)amino]-N-(p-tolyl)acetamide; oxalic acid CAS Name: N-(4-methylphenyl)-2-[[1-(phenylmethyl)-3-pyrrolidinyl]amino]acetamide; oxalic acid IUPAC Name: 2-[(1-benzylpyrrolidin-3-yl)amino]-N-(4-methylphenyl)acetamide; oxalic acid Traditional Name: 2-[(1-benzylpyrrolidin-3-yl)amino]-N-(p-tolyl)acetamide; oxalic acid Formula: C24H29N3O9 MolecularWeight: 503.50176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CNC2CCN(C2)CC3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CNC2CCN(C2)CC3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25N3O.2C2H2O4/c1-16-7-9-18(10-8-16)22-20(24)13-21-19-11-12-23(15-19)14-17-5-3-2-4-6-17;2*3-1(4)2(5)6/h2-10,19,21H,11-15H2,1H3,(H,22,24);2*(H,3,4)(H,5,6)