1-[4-[[(2S)-2-azanyl-2-methyl-3-oxidanyl-propoxy]methyl]phenyl]-4-(4-methylphenyl)butan-1-one

Systemtic Name: 1-[4-[[(2S)-2-azanyl-2-methyl-3-oxidanyl-propoxy]methyl]phenyl]-4-(4-methylphenyl)butan-1-one Openeye Name: 1-[4-[[(2S)-2-amino-3-hydroxy-2-methyl-propoxy]methyl]phenyl]-4-(p-tolyl)butan-1-one CAS Name: 1-[4-[[(2S)-2-amino-3-hydroxy-2-methylpropoxy]methyl]phenyl]-4-(4-methylphenyl)-1-butanone IUPAC Name: 1-[4-[[(2S)-2-amino-3-hydroxy-2-methylpropoxy]methyl]phenyl]-4-(4-methylphenyl)butan-1-one Traditional Name: 1-[4-[[(2S)-2-amino-3-hydroxy-2-methyl-propoxy]methyl]phenyl]-4-(p-tolyl)butan-1-one Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCC(=O)C2=CC=C(C=C2)COCC(C)(CO)N

Isomeric SMILES

CC1=CC=C(C=C1)CCCC(=O)C2=CC=C(C=C2)COC[C@](C)(CO)N

InChI

InChI=1S/C22H29NO3/c1-17-6-8-18(9-7-17)4-3-5-21(25)20-12-10-19(11-13-20)14-26-16-22(2,23)15-24/h6-13,24H,3-5,14-16,23H2,1-2H3/t22-/m0/s1