1-methyl-4-[3-oxidanyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]pyrrole-2-carboxylic acid

Systemtic Name: 1-methyl-4-[3-oxidanyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]pyrrole-2-carboxylic acid Openeye Name: 4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]-1-methyl-pyrrole-2-carboxylic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C(C#CC3=CN(C(=C3)C(=O)O)C)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C(C#CC3=CN(C(=C3)C(=O)O)C)O)(C)C)C

InChI

InChI=1S/C23H27NO3/c1-22(2)10-11-23(3,4)18-13-16(7-8-17(18)22)20(25)9-6-15-12-19(21(26)27)24(5)14-15/h7-8,12-14,20,25H,10-11H2,1-5H3,(H,26,27)