4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-thiophen-2-yl-ethanoate hydrochloride

Systemtic Name: 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-thiophen-2-yl-ethanoate hydrochloride Openeye Name: 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-(2-thienyl)acetate hydrochloride CAS Name: 2-cyclohexyl-2-hydroxy-2-thiophen-2-ylacetic acid 4-(diethylamino)but-2-ynyl ester hydrochloride IUPAC Name: 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-thiophen-2-ylacetate hydrochloride Traditional Name: 2-cyclohexyl-2-hydroxy-2-(2-thienyl)acetic acid 4-(diethylamino)but-2-ynyl ester hydrochloride Formula: C20H30ClNO3S MolecularWeight: 399.9751

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CS2)O.Cl

Isomeric SMILES

CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CS2)O.Cl

InChI

InChI=1S/C20H29NO3S.ClH/c1-3-21(4-2)14-8-9-15-24-19(22)20(23,18-13-10-16-25-18)17-11-6-5-7-12-17;/h10,13,16-17,23H,3-7,11-12,14-15H2,1-2H3;1H