methyl 4-[[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(5,6-dimethyl-3-benzofuranyl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H21NO4/c1-13-8-18-17(12-26-19(18)9-14(13)2)10-20(23)22-11-15-4-6-16(7-5-15)21(24)25-3/h4-9,12H,10-11H2,1-3H3,(H,22,23)