(E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-2-(2-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-2-(2-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[3-methoxy-4-(2-thienylmethoxy)phenyl]-2-(2-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-2-[(2-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-2-(2-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[3-methoxy-4-(2-thenyloxy)phenyl]-2-o-toluoyl-acrylonitrile Formula: C23H19NO3S MolecularWeight: 389.46686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CS3)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=CS3)OC)/C#N

InChI

InChI=1S/C23H19NO3S/c1-16-6-3-4-8-20(16)23(25)18(14-24)12-17-9-10-21(22(13-17)26-2)27-15-19-7-5-11-28-19/h3-13H,15H2,1-2H3/b18-12+