methyl (3E)-3-(phenylcarbamoylhydrazinylidene)-2-(prop-2-ynylamino)butanoate

Systemtic Name: methyl (3E)-3-(phenylcarbamoylhydrazinylidene)-2-(prop-2-ynylamino)butanoate Openeye Name: methyl (3E)-3-(phenylcarbamoylhydrazono)-2-(prop-2-ynylamino)butanoate CAS Name: (3E)-3-[[anilino(oxo)methyl]hydrazinylidene]-2-(prop-2-ynylamino)butanoic acid methyl ester IUPAC Name: methyl (3E)-3-(phenylcarbamoylhydrazinylidene)-2-(prop-2-ynylamino)butanoate Traditional Name: (3E)-3-(phenylcarbamoylhydrazono)-2-(propargylamino)butyric acid methyl ester Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)NC1=CC=CC=C1)C(C(=O)OC)NCC#C

Isomeric SMILES

C/C(=N\NC(=O)NC1=CC=CC=C1)/C(C(=O)OC)NCC#C

InChI

InChI=1S/C15H18N4O3/c1-4-10-16-13(14(20)22-3)11(2)18-19-15(21)17-12-8-6-5-7-9-12/h1,5-9,13,16H,10H2,2-3H3,(H2,17,19,21)/b18-11+