butyl 4-[2-[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-3-(5-methyl-2-furyl)acryloyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=CC=C(O2)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC=C(O2)C

InChI

InChI=1S/C21H23NO6/c1-3-4-13-26-21(25)16-6-8-17(9-7-16)22-19(23)14-27-20(24)12-11-18-10-5-15(2)28-18/h5-12H,3-4,13-14H2,1-2H3,(H,22,23)/b12-11+