N-[(4-chlorophenyl)methyl]-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)-1H-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)-1H-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-(3-hydroxyprop-1-ynyl)-4-keto-1H-cinnoline-3-carboxamide Formula: C19H14ClN3O3 MolecularWeight: 367.78576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=NNC3=C(C2=O)C=C(C=C3)C#CCO)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=NNC3=C(C2=O)C=C(C=C3)C#CCO)Cl

InChI

InChI=1S/C19H14ClN3O3/c20-14-6-3-13(4-7-14)11-21-19(26)17-18(25)15-10-12(2-1-9-24)5-8-16(15)22-23-17/h3-8,10,24H,9,11H2,(H,21,26)(H,22,25)