methyl 3-[2-(2-methanoyl-5-propoxy-phenoxy)ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-(2-methanoyl-5-propoxy-phenoxy)ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(2-formyl-5-propoxy-phenoxy)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(2-formyl-5-propoxyphenoxy)-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-formyl-5-propoxyphenoxy)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(2-formyl-5-propoxy-phenoxy)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C=O)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C=O)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C21H23NO6/c1-4-9-27-17-8-7-16(12-23)19(11-17)28-13-20(24)22-18-10-15(21(25)26-3)6-5-14(18)2/h5-8,10-12H,4,9,13H2,1-3H3,(H,22,24)