3-[2-[[bis(phenylmethyl)amino]methyl]-3-oxidanylidene-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride

Systemtic Name: 3-[2-[[bis(phenylmethyl)amino]methyl]-3-oxidanylidene-1-phenyl-butyl]-2-oxidanyl-chromen-4-one hydrochloride Openeye Name: 3-[2-[(dibenzylamino)methyl]-3-oxo-1-phenyl-butyl]-2-hydroxy-chromen-4-one hydrochloride CAS Name: 3-[2-[[bis(phenylmethyl)amino]methyl]-3-oxo-1-phenylbutyl]-2-hydroxy-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[2-[(dibenzylamino)methyl]-3-oxo-1-phenylbutyl]-2-hydroxychromen-4-one hydrochloride Traditional Name: 3-[2-[(dibenzylamino)methyl]-3-keto-1-phenyl-butyl]-2-hydroxy-chromone hydrochloride Formula: C34H32ClNO4 MolecularWeight: 554.07518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN(CC1=CC=CC=C1)CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=C(OC5=CC=CC=C5C4=O)O.Cl

Isomeric SMILES

CC(=O)C(CN(CC1=CC=CC=C1)CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=C(OC5=CC=CC=C5C4=O)O.Cl

InChI

InChI=1S/C34H31NO4.ClH/c1-24(36)29(23-35(21-25-13-5-2-6-14-25)22-26-15-7-3-8-16-26)31(27-17-9-4-10-18-27)32-33(37)28-19-11-12-20-30(28)39-34(32)38;/h2-20,29,31,38H,21-23H2,1H3;1H