ethyl (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylidene)-1-methyl-azepan-2-ylidene]propanoate

Systemtic Name: ethyl (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylidene)-1-methyl-azepan-2-ylidene]propanoate Openeye Name: ethyl (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylene)-1-methyl-azepan-2-ylidene]propanoate CAS Name: (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylidene)-1-methyl-2-azepanylidene]propanoic acid ethyl ester IUPAC Name: ethyl (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylidene)-1-methylazepan-2-ylidene]propanoate Traditional Name: (3E)-2-cyano-3-[(3Z)-3-(dimethylaminomethylene)-1-methyl-azepan-2-ylidene]propionic acid ethyl ester Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=C1C(=CN(C)C)CCCCN1C)C#N

Isomeric SMILES

CCOC(=O)C(/C=C/1\C(=C/N(C)C)\CCCCN1C)C#N

InChI

InChI=1S/C16H25N3O2/c1-5-21-16(20)14(11-17)10-15-13(12-18(2)3)8-6-7-9-19(15)4/h10,12,14H,5-9H2,1-4H3/b13-12-,15-10+