5-[[3-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]indol-1-yl]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[3-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]indol-1-yl]methyl]furan-2-carboxylic acid Openeye Name: 5-[[3-[(E)-[(2-cyanoacetyl)hydrazono]methyl]indol-1-yl]methyl]furan-2-carboxylic acid CAS Name: 5-[[3-[(E)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]-1-indolyl]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-[(E)-[(2-cyanoacetyl)hydrazinylidene]methyl]indol-1-yl]methyl]furan-2-carboxylic acid Traditional Name: 5-[[3-[(E)-[(2-cyanoacetyl)hydrazono]methyl]indol-1-yl]methyl]-2-furoic acid Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(O3)C(=O)O)C=NNC(=O)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(O3)C(=O)O)/C=N/NC(=O)CC#N

InChI

InChI=1S/C18H14N4O4/c19-8-7-17(23)21-20-9-12-10-22(15-4-2-1-3-14(12)15)11-13-5-6-16(26-13)18(24)25/h1-6,9-10H,7,11H2,(H,21,23)(H,24,25)/b20-9+