ethyl 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-benzoate

Systemtic Name: ethyl 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-benzoate Openeye Name: ethyl 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]amino]-4-methyl-benzoic acid ethyl ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H19NO5/c1-3-24-20(23)15-7-4-13(2)16(11-15)21-19(22)9-6-14-5-8-17-18(10-14)26-12-25-17/h4-11H,3,12H2,1-2H3,(H,21,22)/b9-6+