3-[2-(diethylaminomethyl)-3-oxidanylidene-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride

Systemtic Name: 3-[2-(diethylaminomethyl)-3-oxidanylidene-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride Openeye Name: 3-[2-(diethylaminomethyl)-3-oxo-1-phenyl-butyl]-2-hydroxy-chromen-4-one hydrochloride CAS Name: 3-[2-(diethylaminomethyl)-3-oxo-1-phenylbutyl]-2-hydroxy-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[2-(diethylaminomethyl)-3-oxo-1-phenylbutyl]-2-hydroxychromen-4-one hydrochloride Traditional Name: 3-[2-(diethylaminomethyl)-3-keto-1-phenyl-butyl]-2-hydroxy-chromone hydrochloride Formula: C24H28ClNO4 MolecularWeight: 429.93642

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O)C(=O)C.Cl

Isomeric SMILES

CCN(CC)CC(C(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O)C(=O)C.Cl

InChI

InChI=1S/C24H27NO4.ClH/c1-4-25(5-2)15-19(16(3)26)21(17-11-7-6-8-12-17)22-23(27)18-13-9-10-14-20(18)29-24(22)28;/h6-14,19,21,28H,4-5,15H2,1-3H3;1H