N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2-oxo-chromene-3-carboxamide CAS Name: N-[3-cyano-4-[4-(2-hydroxyethyl)-1-piperazinyl]phenyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2-oxochromene-3-carboxamide Traditional Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazino]phenyl]-2-keto-chromene-3-carboxamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C#N

InChI

InChI=1S/C23H22N4O4/c24-15-17-13-18(5-6-20(17)27-9-7-26(8-10-27)11-12-28)25-22(29)19-14-16-3-1-2-4-21(16)31-23(19)30/h1-6,13-14,28H,7-12H2,(H,25,29)