ethyl 4-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxymethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxymethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enoxy]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[(E)-3-(5-methyl-2-furyl)acryloyl]oxymethyl]quinoline-3-carboxylic acid ethyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C=CC3=CC=C(O3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)/C=C/C3=CC=C(O3)C)C

InChI

InChI=1S/C22H21NO5/c1-4-26-22(25)21-15(3)17-7-5-6-8-18(17)23-19(21)13-27-20(24)12-11-16-10-9-14(2)28-16/h5-12H,4,13H2,1-3H3/b12-11+