1-[2,4-dimethyl-6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]octan-1-one

Systemtic Name: 1-[2,4-dimethyl-6-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]octan-1-one Openeye Name: 1-[2-[2-hydroxy-3-(isopropylamino)propoxy]-4,6-dimethyl-phenyl]octan-1-one CAS Name: 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,6-dimethylphenyl]-1-octanone IUPAC Name: 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,6-dimethylphenyl]octan-1-one Traditional Name: 1-[2-[2-hydroxy-3-(isopropylamino)propoxy]-4,6-dimethyl-phenyl]octan-1-one Formula: C22H37NO3 MolecularWeight: 363.53408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(C=C(C=C1OCC(CNC(C)C)O)C)C

Isomeric SMILES

CCCCCCCC(=O)C1=C(C=C(C=C1OCC(CNC(C)C)O)C)C

InChI

InChI=1S/C22H37NO3/c1-6-7-8-9-10-11-20(25)22-18(5)12-17(4)13-21(22)26-15-19(24)14-23-16(2)3/h12-13,16,19,23-24H,6-11,14-15H2,1-5H3