4-[[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid

Systemtic Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid Openeye Name: 4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)acryloyl]amino]-3-methyl-benzoic acid Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C=CC2=CC(=C(C=C2)OCC=C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)/C=C/C2=CC(=C(C=C2)OCC=C)OC

InChI

InChI=1S/C21H21NO5/c1-4-11-27-18-9-5-15(13-19(18)26-3)6-10-20(23)22-17-8-7-16(21(24)25)12-14(17)2/h4-10,12-13H,1,11H2,2-3H3,(H,22,23)(H,24,25)/b10-6+