3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-(4-ethylphenyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-(4-ethylphenyl)-1-benzofuran-2-carboxamide Openeye Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-(4-ethylphenyl)benzofuran-2-carboxamide CAS Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]-N-(4-ethylphenyl)-2-benzofurancarboxamide IUPAC Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-(4-ethylphenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]amino]-N-(4-ethylphenyl)coumarilamide Formula: C27H22N2O5 MolecularWeight: 454.47398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)/C=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H22N2O5/c1-2-17-7-11-19(12-8-17)28-27(31)26-25(20-5-3-4-6-21(20)34-26)29-24(30)14-10-18-9-13-22-23(15-18)33-16-32-22/h3-15H,2,16H2,1H3,(H,28,31)(H,29,30)/b14-10+