methyl 7-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]heptanoate

Systemtic Name: methyl 7-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]heptanoate Openeye Name: methyl 7-[[(E)-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]amino]heptanoate CAS Name: 7-[[(E)-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]heptanoate Traditional Name: 7-[[(E)-3-(2-ethylbenzofuran-3-yl)acryloyl]amino]enanthic acid methyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C21H27NO4/c1-3-18-17(16-10-7-8-11-19(16)26-18)13-14-20(23)22-15-9-5-4-6-12-21(24)25-2/h7-8,10-11,13-14H,3-6,9,12,15H2,1-2H3,(H,22,23)/b14-13+