ethyl (E)-2-cyano-4-(1-hexadecylpyridin-4-ylidene)but-2-enoate

Systemtic Name: ethyl (E)-2-cyano-4-(1-hexadecylpyridin-4-ylidene)but-2-enoate Openeye Name: ethyl (E)-2-cyano-4-(1-hexadecyl-4-pyridylidene)but-2-enoate CAS Name: (E)-2-cyano-4-(1-hexadecyl-4-pyridinylidene)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-4-(1-hexadecylpyridin-4-ylidene)but-2-enoate Traditional Name: (E)-4-(1-cetyl-4-pyridylidene)-2-cyano-but-2-enoic acid ethyl ester Formula: C28H44N2O2 MolecularWeight: 440.66116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C=CC(=CC=C(C#N)C(=O)OCC)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C=CC(=C/C=C(\C#N)/C(=O)OCC)C=C1

InChI

InChI=1S/C28H44N2O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-23-20-26(21-24-30)18-19-27(25-29)28(31)32-4-2/h18-21,23-24H,3-17,22H2,1-2H3/b27-19+