methyl 1-(1-oxidanyl-1-phenyl-5-pyrrolidin-1-yl-pent-3-ynyl)cyclopentane-1-carboxylate

Systemtic Name: methyl 1-(1-oxidanyl-1-phenyl-5-pyrrolidin-1-yl-pent-3-ynyl)cyclopentane-1-carboxylate Openeye Name: methyl 1-(1-hydroxy-1-phenyl-5-pyrrolidin-1-yl-pent-3-ynyl)cyclopentanecarboxylate CAS Name: 1-[1-hydroxy-1-phenyl-5-(1-pyrrolidinyl)pent-3-ynyl]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-(1-hydroxy-1-phenyl-5-pyrrolidin-1-ylpent-3-ynyl)cyclopentane-1-carboxylate Traditional Name: 1-(1-hydroxy-1-phenyl-5-pyrrolidino-pent-3-ynyl)cyclopentanecarboxylic acid methyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCC1)C(CC#CCN2CCCC2)(C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1(CCCC1)C(CC#CCN2CCCC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H29NO3/c1-26-20(24)21(13-5-6-14-21)22(25,19-11-3-2-4-12-19)15-7-8-16-23-17-9-10-18-23/h2-4,11-12,25H,5-6,9-10,13-18H2,1H3