3-[(3E)-3-diazanylidene-2-(dimethylaminomethyl)-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride

Systemtic Name: 3-[(3E)-3-diazanylidene-2-(dimethylaminomethyl)-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride Openeye Name: 3-[(3E)-2-(dimethylaminomethyl)-3-hydrazinylidene-1-phenyl-butyl]-2-hydroxy-chromen-4-one hydrochloride CAS Name: 3-[(3E)-2-(dimethylaminomethyl)-3-hydrazinylidene-1-phenylbutyl]-2-hydroxy-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[(3E)-2-(dimethylaminomethyl)-3-hydrazinylidene-1-phenylbutyl]-2-hydroxychromen-4-one hydrochloride Traditional Name: 3-[(3E)-2-(dimethylaminomethyl)-3-hydrazono-1-phenyl-butyl]-2-hydroxy-chromone hydrochloride Formula: C22H26ClN3O3 MolecularWeight: 415.91314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=N\N)/C(CN(C)C)C(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O.Cl

InChI

InChI=1S/C22H25N3O3.ClH/c1-14(24-23)17(13-25(2)3)19(15-9-5-4-6-10-15)20-21(26)16-11-7-8-12-18(16)28-22(20)27;/h4-12,17,19,27H,13,23H2,1-3H3;1H/b24-14+;