3-methylbutyl (E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: 3-methylbutyl (E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyano-prop-2-enoate Openeye Name: isopentyl (E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-(4-chlorophenyl)-2-furanyl]-2-cyano-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-acrylic acid isoamyl ester Formula: C19H18ClNO3 MolecularWeight: 343.80412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC(C)CCOC(=O)/C(=C/C1=CC=C(O1)C2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C19H18ClNO3/c1-13(2)9-10-23-19(22)15(12-21)11-17-7-8-18(24-17)14-3-5-16(20)6-4-14/h3-8,11,13H,9-10H2,1-2H3/b15-11+