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

Systemtic Name: [4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate; sulfuric acid Openeye Name: [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] propanoate; sulfuric acid CAS Name: propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester; sulfuric acid IUPAC Name: [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate; sulfuric acid Traditional Name: propionic acid [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] ester; sulfuric acid Formula: C22H31NO6S MolecularWeight: 437.54964

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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.OS(=O)(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO2.H2O4S/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;1-5(2,3)4/h6-15,18H,5,16-17H2,1-4H3;(H2,1,2,3,4)