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

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acrylonitrile Formula: C20H18ClNO3 MolecularWeight: 355.81482

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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=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClNO3/c1-13(2)25-20-17(21)10-14(11-18(20)24-3)9-16(12-22)19(23)15-7-5-4-6-8-15/h4-11,13H,1-3H3/b16-9+