CAS RN: 22948-02-3
CAS Name: 3-aminobenzenethiolate
OPENEYE Name: 3-aminobenzenethiolate
IUPAC Name: 3-aminobenzenethiolate
SYSTEMATIC NAME: 3-azanylbenzenethiolate
MOLECULAR FORMULA: C6H6NS-
MOLECULAR WEIGHT: 124.18354
SMILES: C1=CC(=CC(=C1)[S-])N
Structure:
CAS RN: 41361-28-8
CAS Name: 1-ethyl-3-piperidin-1-iumone
OPENEYE Name: 1-ethylpiperidin-1-ium-3-one
IUPAC Name: 1-ethylpiperidin-1-ium-3-one
SYSTEMATIC NAME: 1-ethylpiperidin-1-ium-3-one
MOLECULAR FORMULA: C7H14NO+
MOLECULAR WEIGHT: 128.19216
SMILES: CC[NH+]1CCCC(=O)C1
Structure:
CAS RN: 6485-55-8
CAS Name: (2S,6R)-2,6-dimethylmorpholin-4-ium
OPENEYE Name: (2S,6R)-2,6-dimethylmorpholin-4-ium
IUPAC Name: (2S,6R)-2,6-dimethylmorpholin-4-ium
SYSTEMATIC NAME: (2S,6R)-2,6-dimethylmorpholin-4-ium
MOLECULAR FORMULA: C6H14NO+
MOLECULAR WEIGHT: 116.18146
SMILES: C[C@@H]1C[NH2+]C[C@@H](O1)C
Structure:
CAS RN: 3718-88-5
CAS Name: (3-iodophenyl)methylammonium
OPENEYE Name: (3-iodophenyl)methylammonium
IUPAC Name: (3-iodophenyl)methylazanium
SYSTEMATIC NAME: (3-iodanylphenyl)methylazanium
MOLECULAR FORMULA: C7H9IN+
MOLECULAR WEIGHT: 234.05753
SMILES: C1=CC(=CC(=C1)I)C[NH3+]
Structure:
CAS RN: 41202-77-1
CAS Name: 1-(2,3-dichlorophenyl)piperazin-4-ium
OPENEYE Name: 1-(2,3-dichlorophenyl)piperazin-4-ium
IUPAC Name: 1-(2,3-dichlorophenyl)piperazin-4-ium
SYSTEMATIC NAME: 1-[2,3-bis(chloranyl)phenyl]piperazin-4-ium
MOLECULAR FORMULA: C10H13Cl2N2+
MOLECULAR WEIGHT: 232.12962
SMILES: C1CN(CC[NH2+]1)C2=C(C(=CC=C2)Cl)Cl
Structure:
CAS RN: 1429-44-3
CAS Name: 4-chloro-3-(methylsulfamoyl)benzoate
OPENEYE Name: 4-chloro-3-(methylsulfamoyl)benzoate
IUPAC Name: 4-chloro-3-(methylsulfamoyl)benzoate
SYSTEMATIC NAME: 4-chloranyl-3-(methylsulfamoyl)benzoate
MOLECULAR FORMULA: C8H7ClNO4S-
MOLECULAR WEIGHT: 248.66348
SMILES: CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])Cl
Structure:
CAS RN: 332394-38-4
CAS Name: (1R,2R)-2-[[bis(2-methylpropyl)amino]-oxomethyl]-1-cyclohexanecarboxylate
OPENEYE Name: (1R,2R)-2-(diisobutylcarbamoyl)cyclohexanecarboxylate
IUPAC Name: (1R,2R)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
SYSTEMATIC NAME: (1R,2R)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
MOLECULAR FORMULA: C16H28NO3-
MOLECULAR WEIGHT: 282.39842
SMILES: CC(C)CN(CC(C)C)C(=O)[C@@H]1CCCC[C@H]1C(=O)[O-]
Structure:
CAS RN: 332394-38-4
CAS Name: (1S,2R)-2-[[bis(2-methylpropyl)amino]-oxomethyl]-1-cyclohexanecarboxylate
OPENEYE Name: (1S,2R)-2-(diisobutylcarbamoyl)cyclohexanecarboxylate
IUPAC Name: (1S,2R)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
SYSTEMATIC NAME: (1S,2R)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
MOLECULAR FORMULA: C16H28NO3-
MOLECULAR WEIGHT: 282.39842
SMILES: CC(C)CN(CC(C)C)C(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-]
Structure:
CAS RN: 332394-38-4
CAS Name: (1S,2S)-2-[[bis(2-methylpropyl)amino]-oxomethyl]-1-cyclohexanecarboxylate
OPENEYE Name: (1S,2S)-2-(diisobutylcarbamoyl)cyclohexanecarboxylate
IUPAC Name: (1S,2S)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
SYSTEMATIC NAME: (1S,2S)-2-[bis(2-methylpropyl)carbamoyl]cyclohexane-1-carboxylate
MOLECULAR FORMULA: C16H28NO3-
MOLECULAR WEIGHT: 282.39842
SMILES: CC(C)CN(CC(C)C)C(=O)[C@H]1CCCC[C@@H]1C(=O)[O-]
Structure:
CAS RN: 436086-78-1
CAS Name: 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate
OPENEYE Name: 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxo-pentanoate
IUPAC Name: 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate
SYSTEMATIC NAME: 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxidanylidene-pentanoate
MOLECULAR FORMULA: C13H13N2O4S-
MOLECULAR WEIGHT: 293.31832
SMILES: COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC(=O)[O-]
Structure:
CAS RN: 73776-25-7
CAS Name: 2-chloro-3-quinolinecarboxylate
OPENEYE Name: 2-chloroquinoline-3-carboxylate
IUPAC Name: 2-chloroquinoline-3-carboxylate
SYSTEMATIC NAME: 2-chloranylquinoline-3-carboxylate
MOLECULAR FORMULA: C10H5ClNO2-
MOLECULAR WEIGHT: 206.6052
SMILES: C1=CC=C2C(=C1)C=C(C(=N2)Cl)C(=O)[O-]
Structure:
CAS RN: 436088-42-5
CAS Name: (5R,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
OPENEYE Name: (5R,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
IUPAC Name: (5R,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: (5R,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C9H9F3N3O2-
MOLECULAR WEIGHT: 248.18187
SMILES: C[C@@H]1C[C@@H](N2C(=N1)C(=CN2)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-42-5
CAS Name: (5S,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
OPENEYE Name: (5S,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
IUPAC Name: (5S,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: (5S,7R)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C9H9F3N3O2-
MOLECULAR WEIGHT: 248.18187
SMILES: C[C@H]1C[C@@H](N2C(=N1)C(=CN2)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-42-5
CAS Name: (5R,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
OPENEYE Name: (5R,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
IUPAC Name: (5R,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: (5R,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C9H9F3N3O2-
MOLECULAR WEIGHT: 248.18187
SMILES: C[C@@H]1C[C@H](N2C(=N1)C(=CN2)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-42-5
CAS Name: (5S,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
OPENEYE Name: (5S,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
IUPAC Name: (5S,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: (5S,7S)-5-methyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C9H9F3N3O2-
MOLECULAR WEIGHT: 248.18187
SMILES: C[C@H]1C[C@H](N2C(=N1)C(=CN2)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-54-9
CAS Name: (5S,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
OPENEYE Name: (5S,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
IUPAC Name: (5S,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
SYSTEMATIC NAME: (5S,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
MOLECULAR FORMULA: C12H13F3N3O2-
MOLECULAR WEIGHT: 288.24573
SMILES: CC1(CC1)[C@@H]2C[C@@H](N3C(=N2)C=C(N3)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-54-9
CAS Name: (5R,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
OPENEYE Name: (5R,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
IUPAC Name: (5R,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
SYSTEMATIC NAME: (5R,7R)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
MOLECULAR FORMULA: C12H13F3N3O2-
MOLECULAR WEIGHT: 288.24573
SMILES: CC1(CC1)[C@H]2C[C@@H](N3C(=N2)C=C(N3)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-54-9
CAS Name: (5S,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
OPENEYE Name: (5S,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
IUPAC Name: (5S,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
SYSTEMATIC NAME: (5S,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
MOLECULAR FORMULA: C12H13F3N3O2-
MOLECULAR WEIGHT: 288.24573
SMILES: CC1(CC1)[C@@H]2C[C@H](N3C(=N2)C=C(N3)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-54-9
CAS Name: (5R,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
OPENEYE Name: (5R,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
IUPAC Name: (5R,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
SYSTEMATIC NAME: (5R,7S)-5-(1-methylcyclopropyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylate
MOLECULAR FORMULA: C12H13F3N3O2-
MOLECULAR WEIGHT: 288.24573
SMILES: CC1(CC1)[C@H]2C[C@H](N3C(=N2)C=C(N3)C(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436088-43-6
CAS Name: 9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline-2-carboxylate
OPENEYE Name: 9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline-2-carboxylate
IUPAC Name: 9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline-2-carboxylate
SYSTEMATIC NAME: 9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline-2-carboxylate
MOLECULAR FORMULA: C12H9F3N3O2-
MOLECULAR WEIGHT: 284.21397
SMILES: C1CCC2=NC3=CC(=NN3C(=C2C1)C(F)(F)F)C(=O)[O-]
Structure:
CAS RN: 88768-46-1
CAS Name: 2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetate
OPENEYE Name: 2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate
IUPAC Name: 2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate
SYSTEMATIC NAME: 2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate
MOLECULAR FORMULA: C8H6F3N2O2S-
MOLECULAR WEIGHT: 251.20565
SMILES: CC1=CC(=NC(=N1)SCC(=O)[O-])C(F)(F)F
Structure:
CAS RN: 436811-12-0
CAS Name: 4-[(2R)-2-carbamoyl-1-pyrrolidinyl]-4-oxobutanoate
OPENEYE Name: 4-[(2R)-2-carbamoylpyrrolidin-1-yl]-4-oxo-butanoate
IUPAC Name: 4-[(2R)-2-carbamoylpyrrolidin-1-yl]-4-oxobutanoate
SYSTEMATIC NAME: 4-[(2R)-2-aminocarbonylpyrrolidin-1-yl]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C9H13N2O4-
MOLECULAR WEIGHT: 213.21052
SMILES: C1C[C@@H](N(C1)C(=O)CCC(=O)[O-])C(=O)N
Structure:
CAS RN: 436811-12-0
CAS Name: 4-[(2S)-2-carbamoyl-1-pyrrolidinyl]-4-oxobutanoate
OPENEYE Name: 4-[(2S)-2-carbamoylpyrrolidin-1-yl]-4-oxo-butanoate
IUPAC Name: 4-[(2S)-2-carbamoylpyrrolidin-1-yl]-4-oxobutanoate
SYSTEMATIC NAME: 4-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C9H13N2O4-
MOLECULAR WEIGHT: 213.21052
SMILES: C1C[C@H](N(C1)C(=O)CCC(=O)[O-])C(=O)N
Structure:
CAS RN: 436088-44-7
CAS Name: 4-oxo-4-[2-(1-piperidinyl)anilino]butanoate
OPENEYE Name: 4-oxo-4-[2-(1-piperidyl)anilino]butanoate
IUPAC Name: 4-oxo-4-(2-piperidin-1-ylanilino)butanoate
SYSTEMATIC NAME: 4-oxidanylidene-4-[(2-piperidin-1-ylphenyl)amino]butanoate
MOLECULAR FORMULA: C15H19N2O3-
MOLECULAR WEIGHT: 275.32296
SMILES: C1CCN(CC1)C2=CC=CC=C2NC(=O)CCC(=O)[O-]
Structure:
CAS RN: 3406-75-5
CAS Name: 2-[(4-nitrophenyl)thio]acetate
OPENEYE Name: 2-(4-nitrophenyl)sulfanylacetate
IUPAC Name: 2-(4-nitrophenyl)sulfanylacetate
SYSTEMATIC NAME: 2-(4-nitrophenyl)sulfanylethanoate
MOLECULAR FORMULA: C8H6NO4S-
MOLECULAR WEIGHT: 212.20254
SMILES: C1=CC(=CC=C1[N+](=O)[O-])SCC(=O)[O-]
Structure:
CAS RN: 13610-66-7
CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)butanoate
OPENEYE Name: 4-(2-oxo-1,3-benzoxazol-3-yl)butanoate
IUPAC Name: 4-(2-oxo-1,3-benzoxazol-3-yl)butanoate
SYSTEMATIC NAME: 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoate
MOLECULAR FORMULA: C11H10NO4-
MOLECULAR WEIGHT: 220.2014
SMILES: C1=CC=C2C(=C1)N(C(=O)O2)CCCC(=O)[O-]
Structure:
CAS RN: 104344-75-4
CAS Name: 3-(1,3-benzothiazol-2-ylamino)propanoate
OPENEYE Name: 3-(1,3-benzothiazol-2-ylamino)propanoate
IUPAC Name: 3-(1,3-benzothiazol-2-ylamino)propanoate
SYSTEMATIC NAME: 3-(1,3-benzothiazol-2-ylamino)propanoate
MOLECULAR FORMULA: C10H9N2O2S-
MOLECULAR WEIGHT: 221.25566
SMILES: C1=CC=C2C(=C1)N=C(S2)NCCC(=O)[O-]
Structure:
CAS RN: 355830-81-8
CAS Name: (1R,6R)-6-[oxo(1-pyrrolidinyl)methyl]-1-cyclohex-3-enecarboxylate
OPENEYE Name: (1R,6R)-6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylate
IUPAC Name: (1R,6R)-6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylate
SYSTEMATIC NAME: (1R,6R)-6-pyrrolidin-1-ylcarbonylcyclohex-3-ene-1-carboxylate
MOLECULAR FORMULA: C12H16NO3-
MOLECULAR WEIGHT: 222.26034
SMILES: C1CCN(C1)C(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-]
Structure:
CAS RN: 355830-81-8
CAS Name: (1R,6S)-6-[oxo(1-pyrrolidinyl)methyl]-1-cyclohex-3-enecarboxylate
OPENEYE Name: (1R,6S)-6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylate
IUPAC Name: (1R,6S)-6-(pyrrolidine-1-carbonyl)cyclohex-3-ene-1-carboxylate
SYSTEMATIC NAME: (1R,6S)-6-pyrrolidin-1-ylcarbonylcyclohex-3-ene-1-carboxylate
MOLECULAR FORMULA: C12H16NO3-
MOLECULAR WEIGHT: 222.26034
SMILES: C1CCN(C1)C(=O)[C@H]2CC=CC[C@H]2C(=O)[O-]
Structure:
CAS RN: 50602-38-5
CAS Name: 2-acetamido-4-thiazolecarboxylate
OPENEYE Name: 2-acetamidothiazole-4-carboxylate
IUPAC Name: 2-acetamido-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: 2-acetamido-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C6H5N2O3S-
MOLECULAR WEIGHT: 185.1805
SMILES: CC(=O)NC1=NC(=CS1)C(=O)[O-]
Structure:
CAS RN: 1140-38-1
CAS Name: 5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxylate
OPENEYE Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylate
IUPAC Name: 5-chloro-3-methyl-1-phenylpyrazole-4-carboxylate
SYSTEMATIC NAME: 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate
MOLECULAR FORMULA: C11H8ClN2O2-
MOLECULAR WEIGHT: 235.64642
SMILES: CC1=NN(C(=C1C(=O)[O-])Cl)C2=CC=CC=C2
Structure:
CAS RN: 247088-99-9
CAS Name: 2-[(2-methyl-1-imidazolyl)-oxomethyl]benzoate
OPENEYE Name: 2-(2-methylimidazole-1-carbonyl)benzoate
IUPAC Name: 2-(2-methylimidazole-1-carbonyl)benzoate
SYSTEMATIC NAME: 2-(2-methylimidazol-1-yl)carbonylbenzoate
MOLECULAR FORMULA: C12H9N2O3-
MOLECULAR WEIGHT: 229.21146
SMILES: CC1=NC=CN1C(=O)C2=CC=CC=C2C(=O)[O-]
Structure:
CAS RN: 99189-60-3
CAS Name: 2-[1-(2-amino-2-oxoethyl)cyclohexyl]acetate
OPENEYE Name: 2-[1-(2-amino-2-oxo-ethyl)cyclohexyl]acetate
IUPAC Name: 2-[1-(2-amino-2-oxoethyl)cyclohexyl]acetate
SYSTEMATIC NAME: 2-[1-(2-azanyl-2-oxidanylidene-ethyl)cyclohexyl]ethanoate
MOLECULAR FORMULA: C10H16NO3-
MOLECULAR WEIGHT: 198.23894
SMILES: C1CCC(CC1)(CC(=O)N)CC(=O)[O-]
Structure:
CAS RN: 1217-58-9
CAS Name: 2-(9H-xanthen-9-yl)acetate
OPENEYE Name: 2-(9H-xanthen-9-yl)acetate
IUPAC Name: 2-(9H-xanthen-9-yl)acetate
SYSTEMATIC NAME: 2-(9H-xanthen-9-yl)ethanoate
MOLECULAR FORMULA: C15H11O3-
MOLECULAR WEIGHT: 239.24604
SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)CC(=O)[O-]
Structure:
CAS RN: 22232-64-0
CAS Name: (1R,2R)-2-(4-phenyl-1-piperidin-1-iumyl)-1-cyclohexanol
OPENEYE Name: (1R,2R)-2-(4-phenylpiperidin-1-ium-1-yl)cyclohexanol
IUPAC Name: (1R,2R)-2-(4-phenylpiperidin-1-ium-1-yl)cyclohexan-1-ol
SYSTEMATIC NAME: (1R,2R)-2-(4-phenylpiperidin-1-ium-1-yl)cyclohexan-1-ol
MOLECULAR FORMULA: C17H26NO+
MOLECULAR WEIGHT: 260.39444
SMILES: C1CC[C@H]([C@@H](C1)[NH+]2CCC(CC2)C3=CC=CC=C3)O
Structure:
CAS RN: 16817-32-6
CAS Name: 3,5-dimethyl-2-benzofurancarboxylate
OPENEYE Name: 3,5-dimethylbenzofuran-2-carboxylate
IUPAC Name: 3,5-dimethyl-1-benzofuran-2-carboxylate
SYSTEMATIC NAME: 3,5-dimethyl-1-benzofuran-2-carboxylate
MOLECULAR FORMULA: C11H9O3-
MOLECULAR WEIGHT: 189.18736
SMILES: CC1=CC2=C(C=C1)OC(=C2C)C(=O)[O-]
Structure:
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