(Z)-4-methoxy-3-(phenylcarbonyl)tridec-2-ene-1,1,2-tricarbonitrile

Systemtic Name: (Z)-4-methoxy-3-(phenylcarbonyl)tridec-2-ene-1,1,2-tricarbonitrile Openeye Name: (Z)-3-benzoyl-4-methoxy-tridec-2-ene-1,1,2-tricarbonitrile CAS Name: (Z)-3-benzoyl-4-methoxy-2-tridecene-1,1,2-tricarbonitrile IUPAC Name: (Z)-3-benzoyl-4-methoxytridec-2-ene-1,1,2-tricarbonitrile Traditional Name: (Z)-3-benzoyl-4-methoxy-tridec-2-ene-1,1,2-tricarbonitrile Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(=C(C#N)C(C#N)C#N)C(=O)C1=CC=CC=C1)OC

Isomeric SMILES

CCCCCCCCCC(/C(=C(/C#N)\C(C#N)C#N)/C(=O)C1=CC=CC=C1)OC

InChI

InChI=1S/C24H29N3O2/c1-3-4-5-6-7-8-12-15-22(29-2)23(21(18-27)20(16-25)17-26)24(28)19-13-10-9-11-14-19/h9-11,13-14,20,22H,3-8,12,15H2,1-2H3/b23-21+