N-[(4-chlorophenyl)methyl]-5-oxidanyl-2-oxidanylidene-3-(3-oxidanylprop-1-ynyl)chromene-6-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-oxidanyl-2-oxidanylidene-3-(3-oxidanylprop-1-ynyl)chromene-6-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-oxo-chromene-6-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-oxo-1-benzopyran-6-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-oxochromene-6-carboxamide Traditional Name: N-(4-chlorobenzyl)-5-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-keto-chromene-6-carboxamide Formula: C20H14ClNO5 MolecularWeight: 383.78186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClNO5/c21-14-5-3-12(4-6-14)11-22-19(25)15-7-8-17-16(18(15)24)10-13(2-1-9-23)20(26)27-17/h3-8,10,23-24H,9,11H2,(H,22,25)