ethanedioic acid; N-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-3,4-dimethyl-aniline

Systemtic Name: ethanedioic acid; N-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-3,4-dimethyl-aniline Openeye Name: N-[(3-benzyloxy-4-methoxy-phenyl)methyl]-3,4-dimethyl-aniline; oxalic acid CAS Name: N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-3,4-dimethylaniline; oxalic acid IUPAC Name: N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-3,4-dimethylaniline; oxalic acid Traditional Name: (3-benzoxy-4-methoxy-benzyl)-(3,4-dimethylphenyl)amine; oxalic acid Formula: C25H27NO6 MolecularWeight: 437.48498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H25NO2.C2H2O4/c1-17-9-11-21(13-18(17)2)24-15-20-10-12-22(25-3)23(14-20)26-16-19-7-5-4-6-8-19;3-1(4)2(5)6/h4-14,24H,15-16H2,1-3H3;(H,3,4)(H,5,6)