3-oxidanyl-3-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]pyrrole-2-carboxylate

Systemtic Name: 3-oxidanyl-3-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]pyrrole-2-carboxylate Openeye Name: 3-hydroxy-3-[3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]pyrrole-2-carboxylate CAS Name: 3-hydroxy-3-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]-2-pyrrolecarboxylate IUPAC Name: 3-hydroxy-3-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]pyrrole-2-carboxylate Traditional Name: 3-hydroxy-3-[3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]pyrrole-2-carboxylate Formula: C22H24NO3- MolecularWeight: 350.43086

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)CC#CC3(C=CN=C3C(=O)[O-])O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)CC#CC3(C=CN=C3C(=O)[O-])O)(C)C)C

InChI

InChI=1S/C22H25NO3/c1-20(2)10-11-21(3,4)17-14-15(7-8-16(17)20)6-5-9-22(26)12-13-23-18(22)19(24)25/h7-8,12-14,26H,6,10-11H2,1-4H3,(H,24,25)/p-1