(2Z,4E)-5-[(1R,6R)-6-ethynyl-2,6-dimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine

Systemtic Name: (2Z,4E)-5-[(1R,6R)-6-ethynyl-2,6-dimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine Openeye Name: (2Z,4E)-5-[(1R,6R)-6-ethynyl-1-hydroxy-2,6-dimethyl-4-oxo-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine CAS Name: (2Z,4E)-5-[(1R,6R)-6-ethynyl-1-hydroxy-2,6-dimethyl-4-oxo-1-cyclohex-2-enyl]-3-methylpenta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine IUPAC Name: (2Z,4E)-5-[(1R,6R)-6-ethynyl-1-hydroxy-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine Traditional Name: (2Z,4E)-5-[(1R,6R)-6-ethynyl-1-hydroxy-4-keto-2,6-dimethyl-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid; 1,1,3,3-tetramethylguanidine Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C#C.CN(C)C(=N)N(C)C

Isomeric SMILES

CC1=CC(=O)C[C@]([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C#C.CN(C)C(=N)N(C)C

InChI

InChI=1S/C16H18O4.C5H13N3/c1-5-15(4)10-13(17)9-12(3)16(15,20)7-6-11(2)8-14(18)19;1-7(2)5(6)8(3)4/h1,6-9,20H,10H2,2-4H3,(H,18,19);6H,1-4H3/b7-6+,11-8-;/t15-,16+;/m0./s1