[2,4-dimethyl-6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-phenyl-methanone hydrochloride

Systemtic Name: [2,4-dimethyl-6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-phenyl-methanone hydrochloride Openeye Name: [2-[2-hydroxy-3-(isopropylamino)propoxy]-4,6-dimethyl-phenyl]-phenyl-methanone hydrochloride CAS Name: [2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,6-dimethylphenyl]-phenylmethanone hydrochloride IUPAC Name: [2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,6-dimethylphenyl]-phenylmethanone hydrochloride Traditional Name: [2-[2-hydroxy-3-(isopropylamino)propoxy]-4,6-dimethyl-phenyl]-phenyl-methanone hydrochloride Formula: C21H28ClNO3 MolecularWeight: 377.90492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(CNC(C)C)O)C(=O)C2=CC=CC=C2)C.Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(CNC(C)C)O)C(=O)C2=CC=CC=C2)C.Cl

InChI

InChI=1S/C21H27NO3.ClH/c1-14(2)22-12-18(23)13-25-19-11-15(3)10-16(4)20(19)21(24)17-8-6-5-7-9-17;/h5-11,14,18,22-23H,12-13H2,1-4H3;1H