methyl (5E)-5-(aminocarbonylhydrazinylidene)-2-cyano-3-phenyl-hexanoate

Systemtic Name: methyl (5E)-5-(aminocarbonylhydrazinylidene)-2-cyano-3-phenyl-hexanoate Openeye Name: methyl (5E)-5-(carbamoylhydrazono)-2-cyano-3-phenyl-hexanoate CAS Name: (5E)-5-(carbamoylhydrazinylidene)-2-cyano-3-phenylhexanoic acid methyl ester IUPAC Name: methyl (5E)-5-(carbamoylhydrazinylidene)-2-cyano-3-phenylhexanoate Traditional Name: (5E)-2-cyano-3-phenyl-5-semicarbazono-hexanoic acid methyl ester Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O3/c1-10(18-19-15(17)21)8-12(11-6-4-3-5-7-11)13(9-16)14(20)22-2/h3-7,12-13H,8H2,1-2H3,(H3,17,19,21)/b18-10+