methyl 3-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 3-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-[(2,3-dimethyl-2,3-dihydrobenzofuran-7-carbonyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-[[(2,3-dimethyl-2,3-dihydrobenzofuran-7-yl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carbonyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[(2,3-dimethylcoumaran-7-carbonyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)NC(CC(=O)OC)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1C(OC2=C(C=CC=C12)C(=O)NC(CC(=O)OC)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H25NO4/c1-13-8-10-16(11-9-13)19(12-20(24)26-4)23-22(25)18-7-5-6-17-14(2)15(3)27-21(17)18/h5-11,14-15,19H,12H2,1-4H3,(H,23,25)