N-[2,7-bis(oxidanyl)-4-oxidanylidene-8-prop-2-ynyl-chromen-3-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2,7-bis(oxidanyl)-4-oxidanylidene-8-prop-2-ynyl-chromen-3-yl]-1H-pyrrole-2-carboxamide Openeye Name: N-(2,7-dihydroxy-4-oxo-8-prop-2-ynyl-chromen-3-yl)-1H-pyrrole-2-carboxamide CAS Name: N-(2,7-dihydroxy-4-oxo-8-prop-2-ynyl-1-benzopyran-3-yl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(2,7-dihydroxy-4-oxo-8-prop-2-ynylchromen-3-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-(2,7-dihydroxy-4-keto-8-propargyl-chromen-3-yl)-1H-pyrrole-2-carboxamide Formula: C17H12N2O5 MolecularWeight: 324.28758

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1=C(C=CC2=C1OC(=C(C2=O)NC(=O)C3=CC=CN3)O)O

Isomeric SMILES

C#CCC1=C(C=CC2=C1OC(=C(C2=O)NC(=O)C3=CC=CN3)O)O

InChI

InChI=1S/C17H12N2O5/c1-2-4-9-12(20)7-6-10-14(21)13(17(23)24-15(9)10)19-16(22)11-5-3-8-18-11/h1,3,5-8,18,20,23H,4H2,(H,19,22)