2-methoxy-5-[[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylamino]methyl]benzoic acid Openeye Name: 5-[[[2-(4-allyl-2-methoxy-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 2-methoxy-5-[[[2-(2-methoxy-4-prop-2-enylphenoxy)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]amino]methyl]benzoic acid Traditional Name: 5-[[[2-(4-allyl-2-methoxy-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)CC=C)OC)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)CC=C)OC)C(=O)O

InChI

InChI=1S/C21H23NO6/c1-4-5-14-6-9-18(19(11-14)27-3)28-13-20(23)22-12-15-7-8-17(26-2)16(10-15)21(24)25/h4,6-11H,1,5,12-13H2,2-3H3,(H,22,23)(H,24,25)