[4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate; 2-(3-phenoxyphenyl)propanoic acid

Systemtic Name: [4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate; 2-(3-phenoxyphenyl)propanoic acid Openeye Name: [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] propanoate; 2-(3-phenoxyphenyl)propanoic acid CAS Name: 2-(3-phenoxyphenyl)propanoic acid; propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester IUPAC Name: [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate; 2-(3-phenoxyphenyl)propanoic acid Traditional Name: 2-(3-phenoxyphenyl)propionic acid; propionic acid [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] ester Formula: C37H43NO5 MolecularWeight: 581.74102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H29NO2.C15H14O3/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19;1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h6-15,18H,5,16-17H2,1-4H3;2-11H,1H3,(H,16,17)