N-[(4-chlorophenyl)methyl]-4-oxidanylidene-8-(3-oxidanylprop-1-ynyl)-1H-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-oxidanylidene-8-(3-oxidanylprop-1-ynyl)-1H-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-4-oxo-1H-cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-(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(=C2C(=C1)C(=O)C(=NN2)C(=O)NCC3=CC=C(C=C3)Cl)C#CCO

Isomeric SMILES

C1=CC(=C2C(=C1)C(=O)C(=NN2)C(=O)NCC3=CC=C(C=C3)Cl)C#CCO

InChI

InChI=1S/C19H14ClN3O3/c20-14-8-6-12(7-9-14)11-21-19(26)17-18(25)15-5-1-3-13(4-2-10-24)16(15)22-23-17/h1,3,5-9,24H,10-11H2,(H,21,26)(H,22,25)