1-[4-[(2-azanyl-2-methyl-3-oxidanyl-propoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)butan-1-one

Systemtic Name: 1-[4-[(2-azanyl-2-methyl-3-oxidanyl-propoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)butan-1-one Openeye Name: 1-[4-[(2-amino-3-hydroxy-2-methyl-propoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)butan-1-one CAS Name: 1-[4-[(2-amino-3-hydroxy-2-methylpropoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)-1-butanone IUPAC Name: 1-[4-[(2-amino-3-hydroxy-2-methylpropoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)butan-1-one Traditional Name: 1-[4-[(2-amino-3-hydroxy-2-methyl-propoxy)methyl]phenyl]-4-(3,5-dimethylphenyl)butan-1-one Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO3/c1-17-11-18(2)13-20(12-17)5-4-6-22(26)21-9-7-19(8-10-21)14-27-16-23(3,24)15-25/h7-13,25H,4-6,14-16,24H2,1-3H3