ethyl 4-[(E)-3-[5-(1-benzothiophen-2-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoate

Systemtic Name: ethyl 4-[(E)-3-[5-(1-benzothiophen-2-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoate Openeye Name: ethyl 4-[(E)-3-[5-(benzothiophen-2-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoate CAS Name: 4-[(E)-3-[5-(1-benzothiophen-2-yl)-2,4-dimethoxyphenyl]-1-oxoprop-2-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-[5-(1-benzothiophen-2-yl)-2,4-dimethoxyphenyl]prop-2-enoyl]benzoate Traditional Name: 4-[(E)-3-[5-(benzothiophen-2-yl)-2,4-dimethoxy-phenyl]acryloyl]benzoic acid ethyl ester Formula: C28H24O5S MolecularWeight: 472.55216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(=O)C=CC2=C(C=C(C(=C2)C3=CC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=C(C=C(C(=C2)C3=CC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C28H24O5S/c1-4-33-28(30)19-11-9-18(10-12-19)23(29)14-13-20-15-22(25(32-3)17-24(20)31-2)27-16-21-7-5-6-8-26(21)34-27/h5-17H,4H2,1-3H3/b14-13+