2-[(3-methyl-4-prop-2-enoxy-phenyl)methylamino]benzoic acid

Systemtic Name: 2-[(3-methyl-4-prop-2-enoxy-phenyl)methylamino]benzoic acid Openeye Name: 2-[(4-allyloxy-3-methyl-phenyl)methylamino]benzoic acid CAS Name: 2-[(3-methyl-4-prop-2-enoxyphenyl)methylamino]benzoic acid IUPAC Name: 2-[(3-methyl-4-prop-2-enoxyphenyl)methylamino]benzoic acid Traditional Name: 2-[(4-allyloxy-3-methyl-benzyl)amino]benzoic acid Formula: C18H19NO3 MolecularWeight: 297.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC2=CC=CC=C2C(=O)O)OCC=C

Isomeric SMILES

CC1=C(C=CC(=C1)CNC2=CC=CC=C2C(=O)O)OCC=C

InChI

InChI=1S/C18H19NO3/c1-3-10-22-17-9-8-14(11-13(17)2)12-19-16-7-5-4-6-15(16)18(20)21/h3-9,11,19H,1,10,12H2,2H3,(H,20,21)