N-(4-tert-butylphenyl)-2-[(phenylmethyl)amino]propanamide; ethanedioic acid

Systemtic Name: N-(4-tert-butylphenyl)-2-[(phenylmethyl)amino]propanamide; ethanedioic acid Openeye Name: 2-(benzylamino)-N-(4-tert-butylphenyl)propanamide; oxalic acid CAS Name: N-(4-tert-butylphenyl)-2-[(phenylmethyl)amino]propanamide; oxalic acid IUPAC Name: 2-(benzylamino)-N-(4-tert-butylphenyl)propanamide; oxalic acid Traditional Name: 2-(benzylamino)-N-(4-tert-butylphenyl)propionamide; oxalic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)NCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)NCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O.C2H2O4/c1-15(21-14-16-8-6-5-7-9-16)19(23)22-18-12-10-17(11-13-18)20(2,3)4;3-1(4)2(5)6/h5-13,15,21H,14H2,1-4H3,(H,22,23);(H,3,4)(H,5,6)