octadecyl (Z)-2-cyano-3-oxidanyl-prop-2-enoate

Systemtic Name: octadecyl (Z)-2-cyano-3-oxidanyl-prop-2-enoate Openeye Name: octadecyl (Z)-2-cyano-3-hydroxy-prop-2-enoate CAS Name: (Z)-2-cyano-3-hydroxy-2-propenoic acid octadecyl ester IUPAC Name: octadecyl (Z)-2-cyano-3-hydroxyprop-2-enoate Traditional Name: (Z)-2-cyano-3-hydroxy-acrylic acid stearyl ester Formula: C22H39NO3 MolecularWeight: 365.54996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=CO)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)/C(=C\O)/C#N

InChI

InChI=1S/C22H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-22(25)21(19-23)20-24/h20,24H,2-18H2,1H3/b21-20-