phenyl 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-oxidanyl-2-thiophen-2-yl-ethanoate hydrochloride

Systemtic Name: phenyl 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-oxidanyl-2-thiophen-2-yl-ethanoate hydrochloride Openeye Name: phenyl 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-hydroxy-2-(2-thienyl)acetate hydrochloride CAS Name: 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-hydroxy-2-thiophen-2-ylacetic acid phenyl ester hydrochloride IUPAC Name: phenyl 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-hydroxy-2-thiophen-2-ylacetate hydrochloride Traditional Name: 2-[1-[3-(diethylamino)prop-1-ynyl]cyclopentyl]-2-hydroxy-2-(2-thienyl)acetic acid phenyl ester hydrochloride Formula: C24H30ClNO3S MolecularWeight: 448.0179

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CC1(CCCC1)C(C2=CC=CS2)(C(=O)OC3=CC=CC=C3)O.Cl

Isomeric SMILES

CCN(CC)CC#CC1(CCCC1)C(C2=CC=CS2)(C(=O)OC3=CC=CC=C3)O.Cl

InChI

InChI=1S/C24H29NO3S.ClH/c1-3-25(4-2)18-11-17-23(15-8-9-16-23)24(27,21-14-10-19-29-21)22(26)28-20-12-6-5-7-13-20;/h5-7,10,12-14,19,27H,3-4,8-9,15-16,18H2,1-2H3;1H