3-[(3E)-3-(methylhydrazinylidene)-1-phenyl-5-pyrrolidin-1-yl-pentyl]-2-oxidanyl-chromen-4-one hydrochloride

Systemtic Name: 3-[(3E)-3-(methylhydrazinylidene)-1-phenyl-5-pyrrolidin-1-yl-pentyl]-2-oxidanyl-chromen-4-one hydrochloride Openeye Name: 2-hydroxy-3-[(3E)-3-(methylhydrazono)-1-phenyl-5-pyrrolidin-1-yl-pentyl]chromen-4-one hydrochloride CAS Name: 2-hydroxy-3-[(3E)-3-(methylhydrazinylidene)-1-phenyl-5-(1-pyrrolidinyl)pentyl]-1-benzopyran-4-one hydrochloride IUPAC Name: 2-hydroxy-3-[(3E)-3-(methylhydrazinylidene)-1-phenyl-5-pyrrolidin-1-ylpentyl]chromen-4-one hydrochloride Traditional Name: 2-hydroxy-3-[(3E)-3-(methylhydrazono)-1-phenyl-5-pyrrolidino-pentyl]chromone hydrochloride Formula: C25H30ClN3O3 MolecularWeight: 455.977

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNN=C(CCN1CCCC1)CC(C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)O.Cl

Isomeric SMILES

CN/N=C(/CCN1CCCC1)\CC(C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)O.Cl

InChI

InChI=1S/C25H29N3O3.ClH/c1-26-27-19(13-16-28-14-7-8-15-28)17-21(18-9-3-2-4-10-18)23-24(29)20-11-5-6-12-22(20)31-25(23)30;/h2-6,9-12,21,26,30H,7-8,13-17H2,1H3;1H/b27-19-;