methyl 4-methyl-3-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[4-(3-oxobutyl)phenoxy]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[4-(3-oxobutyl)phenoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[4-(3-oxobutyl)phenoxy]acetyl]amino]benzoate Traditional Name: 3-[[2-[4-(3-ketobutyl)phenoxy]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC2=CC=C(C=C2)CCC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC2=CC=C(C=C2)CCC(=O)C

InChI

InChI=1S/C21H23NO5/c1-14-4-9-17(21(25)26-3)12-19(14)22-20(24)13-27-18-10-7-16(8-11-18)6-5-15(2)23/h4,7-12H,5-6,13H2,1-3H3,(H,22,24)