(Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethylideneamino)pent-2-enoic acid

Systemtic Name: (Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethylideneamino)pent-2-enoic acid Openeye Name: (Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethyleneamino)pent-2-enoic acid CAS Name: (Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethylideneamino)-2-pentenoic acid IUPAC Name: (Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethylideneamino)pent-2-enoic acid Traditional Name: (Z)-5-(4-cyano-1H-indol-3-yl)-2-(dimethylaminomethyleneamino)pent-2-enoic acid Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC(=CCCC1=CNC2=CC=CC(=C21)C#N)C(=O)O

Isomeric SMILES

CN(C)C=N/C(=C\CCC1=CNC2=CC=CC(=C21)C#N)/C(=O)O

InChI

InChI=1S/C17H18N4O2/c1-21(2)11-20-15(17(22)23)8-4-6-13-10-19-14-7-3-5-12(9-18)16(13)14/h3,5,7-8,10-11,19H,4,6H2,1-2H3,(H,22,23)/b15-8-,20-11?