N-[(4-chlorophenyl)methyl]-6-(hydroxymethyl)-1-methyl-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(hydroxymethyl)-1-methyl-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(hydroxymethyl)-1-methyl-4-oxo-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(hydroxymethyl)-1-methyl-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(hydroxymethyl)-1-methyl-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-1-methyl-6-methylol-cinnoline-3-carboxamide Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CO)C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)CO)C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O3/c1-22-15-7-4-12(10-23)8-14(15)17(24)16(21-22)18(25)20-9-11-2-5-13(19)6-3-11/h2-8,23H,9-10H2,1H3,(H,20,25)