butyl (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: butyl (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-2-cyano-acrylic acid butyl ester Formula: C18H22ClNO4 MolecularWeight: 351.82458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC(=C(C(=C1)Cl)OC(C)C)OC)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC(=C(C(=C1)Cl)OC(C)C)OC)/C#N

InChI

InChI=1S/C18H22ClNO4/c1-5-6-7-23-18(21)14(11-20)8-13-9-15(19)17(24-12(2)3)16(10-13)22-4/h8-10,12H,5-7H2,1-4H3/b14-8+