3-[dimethylamino(phenyl)methyl]-2-methyl-3-oxidanyl-4-phenyl-hexanoate

Systemtic Name: 3-[dimethylamino(phenyl)methyl]-2-methyl-3-oxidanyl-4-phenyl-hexanoate Openeye Name: 3-[dimethylamino(phenyl)methyl]-3-hydroxy-2-methyl-4-phenyl-hexanoate CAS Name: 3-[dimethylamino(phenyl)methyl]-3-hydroxy-2-methyl-4-phenylhexanoate IUPAC Name: 3-[dimethylamino(phenyl)methyl]-3-hydroxy-2-methyl-4-phenylhexanoate Traditional Name: 3-[dimethylamino(phenyl)methyl]-3-hydroxy-2-methyl-4-phenyl-hexanoate Formula: C22H28NO3- MolecularWeight: 354.46262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(C(C)C(=O)[O-])(C(C2=CC=CC=C2)N(C)C)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(C(C)C(=O)[O-])(C(C2=CC=CC=C2)N(C)C)O

InChI

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