4-[[(2,5-dimethoxyphenyl)-methyl-amino]methyl]benzoic acid

Systemtic Name: 4-[[(2,5-dimethoxyphenyl)-methyl-amino]methyl]benzoic acid Openeye Name: 4-[(2,5-dimethoxy-N-methyl-anilino)methyl]benzoic acid CAS Name: 4-[(2,5-dimethoxy-N-methylanilino)methyl]benzoic acid IUPAC Name: 4-[(2,5-dimethoxy-N-methylanilino)methyl]benzoic acid Traditional Name: 4-[(2,5-dimethoxy-N-methyl-anilino)methyl]benzoic acid Formula: C17H19NO4 MolecularWeight: 301.33706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)O)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)O)C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C17H19NO4/c1-18(11-12-4-6-13(7-5-12)17(19)20)15-10-14(21-2)8-9-16(15)22-3/h4-10H,11H2,1-3H3,(H,19,20)