ethyl 5-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]-4-(dimethylaminomethyl)-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]-4-(dimethylaminomethyl)-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[3-(1,3-benzodioxol-5-yl)acryloyl]oxy-4-(dimethylaminomethyl)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C30H27NO7 MolecularWeight: 513.53788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC(=O)C=CC3=CC4=C(C=C3)OCO4)CN(C)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC(=O)C=CC3=CC4=C(C=C3)OCO4)CN(C)C)C5=CC=CC=C5

InChI

InChI=1S/C30H27NO7/c1-4-34-30(33)28-27-21(17-31(2)3)22(13-14-24(27)38-29(28)20-8-6-5-7-9-20)37-26(32)15-11-19-10-12-23-25(16-19)36-18-35-23/h5-16H,4,17-18H2,1-3H3