3-(1,3-dihydro-2-benzofuran-5-yl)-2-[(3-methylphenyl)carbonylamino]prop-2-enoic acid

Systemtic Name: 3-(1,3-dihydro-2-benzofuran-5-yl)-2-[(3-methylphenyl)carbonylamino]prop-2-enoic acid Openeye Name: 3-(1,3-dihydroisobenzofuran-5-yl)-2-[(3-methylbenzoyl)amino]prop-2-enoic acid CAS Name: 3-(1,3-dihydroisobenzofuran-5-yl)-2-[[(3-methylphenyl)-oxomethyl]amino]-2-propenoic acid IUPAC Name: 3-(1,3-dihydro-2-benzofuran-5-yl)-2-[(3-methylbenzoyl)amino]prop-2-enoic acid Traditional Name: 2-(m-toluoylamino)-3-phthalan-5-yl-acrylic acid Formula: C19H17NO4 MolecularWeight: 323.34258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=CC2=CC3=C(COC3)C=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=CC2=CC3=C(COC3)C=C2)C(=O)O

InChI

InChI=1S/C19H17NO4/c1-12-3-2-4-14(7-12)18(21)20-17(19(22)23)9-13-5-6-15-10-24-11-16(15)8-13/h2-9H,10-11H2,1H3,(H,20,21)(H,22,23)