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

Systemtic Name: 1-[4-[(2-azanyl-2-methyl-3-oxidanyl-propoxy)methyl]-3-chloranyl-phenyl]-4-(4-methoxyphenyl)butan-1-one Openeye Name: 1-[4-[(2-amino-3-hydroxy-2-methyl-propoxy)methyl]-3-chloro-phenyl]-4-(4-methoxyphenyl)butan-1-one CAS Name: 1-[4-[(2-amino-3-hydroxy-2-methylpropoxy)methyl]-3-chlorophenyl]-4-(4-methoxyphenyl)-1-butanone IUPAC Name: 1-[4-[(2-amino-3-hydroxy-2-methylpropoxy)methyl]-3-chlorophenyl]-4-(4-methoxyphenyl)butan-1-one Traditional Name: 1-[4-[(2-amino-3-hydroxy-2-methyl-propoxy)methyl]-3-chloro-phenyl]-4-(4-methoxyphenyl)butan-1-one Formula: C22H28ClNO4 MolecularWeight: 405.91502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(COCC1=C(C=C(C=C1)C(=O)CCCC2=CC=C(C=C2)OC)Cl)N

Isomeric SMILES

CC(CO)(COCC1=C(C=C(C=C1)C(=O)CCCC2=CC=C(C=C2)OC)Cl)N

InChI

InChI=1S/C22H28ClNO4/c1-22(24,14-25)15-28-13-18-9-8-17(12-20(18)23)21(26)5-3-4-16-6-10-19(27-2)11-7-16/h6-12,25H,3-5,13-15,24H2,1-2H3