methyl 3-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(6,7-dimethylbenzofuran-3-yl)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(6,7-dimethyl-3-benzofuranyl)-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(6,7-dimethyl-1-benzofuran-3-yl)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(6,7-dimethylbenzofuran-3-yl)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C)C

InChI

InChI=1S/C21H21NO4/c1-12-6-8-17-16(11-26-20(17)14(12)3)10-19(23)22-18-9-15(21(24)25-4)7-5-13(18)2/h5-9,11H,10H2,1-4H3,(H,22,23)