[4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)iminomethyl]-2,6-dimethoxy-phenyl] ethanoate

Systemtic Name: [4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)iminomethyl]-2,6-dimethoxy-phenyl] ethanoate Openeye Name: [4-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)iminomethyl]-2,6-dimethoxy-phenyl] acetate CAS Name: acetic acid [4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)iminomethyl]-2,6-dimethoxyphenyl] ester IUPAC Name: [4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)iminomethyl]-2,6-dimethoxyphenyl] acetate Traditional Name: acetic acid [4-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)iminomethyl]-2,6-dimethoxy-phenyl] ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NC2=C(C3=C(S2)CCCC3)C#N)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)C=NC2=C(C3=C(S2)CCCC3)C#N)OC

InChI

InChI=1S/C20H20N2O4S/c1-12(23)26-19-16(24-2)8-13(9-17(19)25-3)11-22-20-15(10-21)14-6-4-5-7-18(14)27-20/h8-9,11H,4-7H2,1-3H3