(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-(2-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-(2-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-(2-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-[(2-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-(2-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-o-anisoyl-acrylonitrile Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)C2=CC=CC=C2OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C(\C#N)/C(=O)C2=CC=CC=C2OC)OC

InChI

InChI=1S/C21H20ClNO4/c1-13(2)27-21-17(22)10-14(11-19(21)26-4)9-15(12-23)20(24)16-7-5-6-8-18(16)25-3/h5-11,13H,1-4H3/b15-9+