3-(2-oxidanylidenepyrrolidin-1-yl)propyl-[(7-oxidanyl-2-oxidanylidene-4-phenyl-chromen-8-yl)methyl]azanium chloride

Systemtic Name: 3-(2-oxidanylidenepyrrolidin-1-yl)propyl-[(7-oxidanyl-2-oxidanylidene-4-phenyl-chromen-8-yl)methyl]azanium chloride Openeye Name: (7-hydroxy-2-oxo-4-phenyl-chromen-8-yl)methyl-[3-(2-oxopyrrolidin-1-yl)propyl]ammonium chloride CAS Name: (7-hydroxy-2-oxo-4-phenyl-1-benzopyran-8-yl)methyl-[3-(2-oxo-1-pyrrolidinyl)propyl]ammonium chloride IUPAC Name: (7-hydroxy-2-oxo-4-phenylchromen-8-yl)methyl-[3-(2-oxopyrrolidin-1-yl)propyl]azanium chloride Traditional Name: (7-hydroxy-2-keto-4-phenyl-chromen-8-yl)methyl-[3-(2-ketopyrrolidino)propyl]ammonium chloride Formula: C23H25ClN2O4 MolecularWeight: 428.9086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCC[NH2+]CC2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

C1CC(=O)N(C1)CCC[NH2+]CC2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C23H24N2O4.ClH/c26-20-10-9-17-18(16-6-2-1-3-7-16)14-22(28)29-23(17)19(20)15-24-11-5-13-25-12-4-8-21(25)27;/h1-3,6-7,9-10,14,24,26H,4-5,8,11-13,15H2;1H