2-[5-(diethylamino)-2-methyl-pent-3-yn-2-yl]oxy-2,2-diphenyl-ethanoate hydrochloride

Systemtic Name: 2-[5-(diethylamino)-2-methyl-pent-3-yn-2-yl]oxy-2,2-diphenyl-ethanoate hydrochloride Openeye Name: 2-[4-(diethylamino)-1,1-dimethyl-but-2-ynoxy]-2,2-diphenyl-acetate hydrochloride CAS Name: 2-[5-(diethylamino)-2-methylpent-3-yn-2-yl]oxy-2,2-diphenylacetate hydrochloride IUPAC Name: 2-[5-(diethylamino)-2-methylpent-3-yn-2-yl]oxy-2,2-diphenylacetate hydrochloride Traditional Name: 2-[4-(diethylamino)-1,1-dimethyl-but-2-ynoxy]-2,2-diphenyl-acetate hydrochloride Formula: C24H29ClNO3- MolecularWeight: 414.94496

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CC(C)(C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)[O-].Cl

Isomeric SMILES

CCN(CC)CC#CC(C)(C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)[O-].Cl

InChI

InChI=1S/C24H29NO3.ClH/c1-5-25(6-2)19-13-18-23(3,4)28-24(22(26)27,20-14-9-7-10-15-20)21-16-11-8-12-17-21;/h7-12,14-17H,5-6,19H2,1-4H3,(H,26,27);1H/p-1