(E)-1-(5-chloranylthiophen-2-yl)-3-(4-methoxy-3-phenylmethoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-chloranylthiophen-2-yl)-3-(4-methoxy-3-phenylmethoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-benzyloxy-4-methoxy-phenyl)-1-(5-chloro-2-thienyl)prop-2-en-1-one CAS Name: (E)-1-(5-chloro-2-thiophenyl)-3-(4-methoxy-3-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-chlorothiophen-2-yl)-3-(4-methoxy-3-phenylmethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-benzoxy-4-methoxy-phenyl)-1-(5-chloro-2-thienyl)prop-2-en-1-one Formula: C21H17ClO3S MolecularWeight: 384.87588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(S2)Cl)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(S2)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C21H17ClO3S/c1-24-18-10-8-15(7-9-17(23)20-11-12-21(22)26-20)13-19(18)25-14-16-5-3-2-4-6-16/h2-13H,14H2,1H3/b9-7+