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

Systemtic Name: 2-acetyloxybenzoic acid; [4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate Openeye Name: 2-acetoxybenzoic acid; [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] propanoate CAS Name: 2-acetyloxybenzoic acid; propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester IUPAC Name: 2-acetyloxybenzoic acid; [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate Traditional Name: 2-acetoxybenzoic acid; propionic acid [1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] ester Formula: C31H37NO6 MolecularWeight: 519.62858

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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(=O)OC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.CC(=O)OC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C22H29NO2.C9H8O4/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;1-6(10)13-8-5-3-2-4-7(8)9(11)12/h6-15,18H,5,16-17H2,1-4H3;2-5H,1H3,(H,11,12)