CAS RN: 124432-70-8
CAS Name: 5-bromo-3-fluoro-2-methoxypyridine
OPENEYE Name: 5-bromo-3-fluoro-2-methoxy-pyridine
IUPAC Name: 5-bromo-3-fluoro-2-methoxypyridine
SYSTEMATIC NAME: 5-bromanyl-3-fluoranyl-2-methoxy-pyridine
MOLECULAR FORMULA: C6H5BrFNO
MOLECULAR WEIGHT: 206.012403
SMILES: COC1=NC=C(C=C1F)Br
Structure:
CAS RN: 84030-04-6
CAS Name: 3-(2-chloroethyl)-2,3-dihydro-1,4-benzodioxin
OPENEYE Name: 3-(2-chloroethyl)-2,3-dihydro-1,4-benzodioxine
IUPAC Name: 3-(2-chloroethyl)-2,3-dihydro-1,4-benzodioxine
SYSTEMATIC NAME: 3-(2-chloroethyl)-2,3-dihydro-1,4-benzodioxine
MOLECULAR FORMULA: C10H11ClO2
MOLECULAR WEIGHT: 198.64614
SMILES: C1C(OC2=CC=CC=C2O1)CCCl
Structure:
CAS RN: 21005-45-8
CAS Name: 1-methyl-6-indolecarboxaldehyde
OPENEYE Name: 1-methylindole-6-carbaldehyde
IUPAC Name: 1-methylindole-6-carbaldehyde
SYSTEMATIC NAME: 1-methylindole-6-carbaldehyde
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: CN1C=CC2=C1C=C(C=C2)C=O
Structure:
CAS RN: 934-69-0
CAS Name: 4-methylene-1-cyclohexanecarboxylic acid
OPENEYE Name: 4-methylenecyclohexanecarboxylic acid
IUPAC Name: 4-methylidenecyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 4-methylidenecyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: C=C1CCC(CC1)C(=O)O
Structure:
CAS RN: 126575-05-1
CAS Name: 3-formamido-3-phenylpropanoic acid
OPENEYE Name: 3-formamido-3-phenyl-propanoic acid
IUPAC Name: 3-formamido-3-phenylpropanoic acid
SYSTEMATIC NAME: 3-formamido-3-phenyl-propanoic acid
MOLECULAR FORMULA: C10H11NO3
MOLECULAR WEIGHT: 193.19924
SMILES: C1=CC=C(C=C1)C(CC(=O)O)NC=O
Structure:
CAS RN: 27240-44-4
CAS Name: 2-amino-3,3,3-trifluoropropanoic acid methyl ester
OPENEYE Name: methyl 2-amino-3,3,3-trifluoro-propanoate
IUPAC Name: methyl 2-amino-3,3,3-trifluoropropanoate
SYSTEMATIC NAME: methyl 2-azanyl-3,3,3-tris(fluoranyl)propanoate
MOLECULAR FORMULA: C4H6F3NO2
MOLECULAR WEIGHT: 157.09115
SMILES: COC(=O)C(C(F)(F)F)N
Structure:
CAS RN: 161511-85-9
CAS Name: 2-(hydroxymethyl)-1-azetidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-(hydroxymethyl)azetidine-1-carboxylate
IUPAC Name: tert-butyl 2-(hydroxymethyl)azetidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 2-(hydroxymethyl)azetidine-1-carboxylate
MOLECULAR FORMULA: C9H17NO3
MOLECULAR WEIGHT: 187.23618
SMILES: CC(C)(C)OC(=O)N1CCC1CO
Structure:
CAS RN: 107020-12-2
CAS Name: (2S)-azetidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester
OPENEYE Name: O1-tert-butyl O2-methyl (2S)-azetidine-1,2-dicarboxylate
IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S)-azetidine-1,2-dicarboxylate
SYSTEMATIC NAME: O1-tert-butyl O2-methyl (2S)-azetidine-1,2-dicarboxylate
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)(C)OC(=O)N1CC[C@H]1C(=O)OC
Structure:
CAS RN: 1039826-29-3
CAS Name: 2-(bromomethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate
IUPAC Name: tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C10H18BrNO2
MOLECULAR WEIGHT: 264.15942
SMILES: CC(C)(C)OC(=O)N1CCCC1CBr
Structure:
CAS RN: 73536-85-3
CAS Name: N-(5-amino-2,3-dihydro-1H-inden-2-yl)acetamide
OPENEYE Name: N-(5-aminoindan-2-yl)acetamide
IUPAC Name: N-(5-amino-2,3-dihydro-1H-inden-2-yl)acetamide
SYSTEMATIC NAME: N-(5-azanyl-2,3-dihydro-1H-inden-2-yl)ethanamide
MOLECULAR FORMULA: C11H14N2O
MOLECULAR WEIGHT: 190.24166
SMILES: CC(=O)NC1CC2=C(C1)C=C(C=C2)N
Structure:
CAS RN: 128985-14-8
CAS Name: (2R,3R,4R,5S)-1-[(E)-3-(2-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
OPENEYE Name: (2R,3R,4R,5S)-1-[(E)-3-(2-fluorophenyl)allyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
IUPAC Name: (2R,3R,4R,5S)-1-[(E)-3-(2-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4R,5S)-1-[(E)-3-(2-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
MOLECULAR FORMULA: C15H20FNO4
MOLECULAR WEIGHT: 297.322003
SMILES: C1[C@@H]([C@H]([C@@H]([C@H](N1C/C=C/C2=CC=CC=C2F)CO)O)O)O
Structure:
CAS RN: 128985-13-7
CAS Name: (2R,3R,4R,5S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
OPENEYE Name: (2R,3R,4R,5S)-1-[(E)-3-(4-fluorophenyl)allyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
IUPAC Name: (2R,3R,4R,5S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4R,5S)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
MOLECULAR FORMULA: C15H20FNO4
MOLECULAR WEIGHT: 297.322003
SMILES: C1[C@@H]([C@H]([C@@H]([C@H](N1C/C=C/C2=CC=C(C=C2)F)CO)O)O)O
Structure:
CAS RN: 128985-10-4
CAS Name: (2R,3R,4R,5S)-1-[3,3-bis(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
OPENEYE Name: (2R,3R,4R,5S)-1-[3,3-bis(4-fluorophenyl)allyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
IUPAC Name: (2R,3R,4R,5S)-1-[3,3-bis(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4R,5S)-1-[3,3-bis(4-fluorophenyl)prop-2-enyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
MOLECULAR FORMULA: C21H23F2NO4
MOLECULAR WEIGHT: 391.408426
SMILES: C1[C@@H]([C@H]([C@@H]([C@H](N1CC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CO)O)O)O
Structure:
CAS RN: 100930-04-9
CAS Name: 4-[[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-4-(methylthio)-1-oxobutyl]amino]-5-[[1-[[1-[[2-[[1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid
OPENEYE Name: 4-[[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methylsulfanyl-butanoyl]amino]-5-[[1-[[1-[[2-[[1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-2-methyl-propyl]amino]-5-oxo-pentanoic acid
IUPAC Name: 4-[[2-[(2-amino-3-hydroxypropanoyl)amino]-4-methylsulfanylbutanoyl]amino]-5-[[1-[[1-[[2-[[1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: 4-[[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methylsulfanyl-butanoyl]amino]-5-[[1-[[5-[bis(azanyl)methylideneamino]-1-[[2-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-pentan-2-yl]amino]-3
MOLECULAR FORMULA: C37H57N11O11S
MOLECULAR WEIGHT: 863.98058
SMILES: CC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CCSC)NC(=O)C(CO)N
Structure:
CAS RN: 93859-54-2
CAS Name: 1-[2-hydroxypropyl-[(Z)-octadec-9-enyl]amino]-2-propanol
OPENEYE Name: 1-[2-hydroxypropyl-[(Z)-octadec-9-enyl]amino]propan-2-ol
IUPAC Name: 1-[2-hydroxypropyl-[(Z)-octadec-9-enyl]amino]propan-2-ol
SYSTEMATIC NAME: 1-[[(Z)-octadec-9-enyl]-(2-oxidanylpropyl)amino]propan-2-ol
MOLECULAR FORMULA: C24H49NO2
MOLECULAR WEIGHT: 383.65136
SMILES: CCCCCCCC/C=C\CCCCCCCCN(CC(C)O)CC(C)O
Structure:
CAS RN: 94107-46-7
CAS Name: 1-[[(Z)-octadec-9-enyl]amino]-2-propanol
OPENEYE Name: 1-[[(Z)-octadec-9-enyl]amino]propan-2-ol
IUPAC Name: 1-[[(Z)-octadec-9-enyl]amino]propan-2-ol
SYSTEMATIC NAME: 1-[[(Z)-octadec-9-enyl]amino]propan-2-ol
MOLECULAR FORMULA: C21H43NO
MOLECULAR WEIGHT: 325.57222
SMILES: CCCCCCCC/C=C\CCCCCCCCNCC(C)O
Structure:
CAS RN: 18179-67-4
CAS Name: sodium [4-[(5-methoxy-2-pyrimidinyl)sulfamoyl]phenyl]azanide
OPENEYE Name: sodium [4-[(5-methoxypyrimidin-2-yl)sulfamoyl]phenyl]azanide
IUPAC Name: sodium [4-[(5-methoxypyrimidin-2-yl)sulfamoyl]phenyl]azanide
SYSTEMATIC NAME: sodium [4-[(5-methoxypyrimidin-2-yl)sulfamoyl]phenyl]azanide
MOLECULAR FORMULA: C11H11N4NaO3S
MOLECULAR WEIGHT: 302.28481
SMILES: COC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)[NH-].[Na+]
Structure:
CAS RN: 63472-64-0
CAS Name: (2S)-2-[[(2R)-6-amino-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-1-oxohexyl]amino]-3-phenylpropanoic acid
OPENEYE Name: (2S)-2-[[(2R)-6-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]hexanoyl]amino]-3-phenyl-propanoic acid
IUPAC Name: (2S)-2-[[(2R)-6-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]hexanoyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2R)-6-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]hexanoyl]amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C24H32N4O4
MOLECULAR WEIGHT: 440.53528
SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)N
Structure:
CAS RN: 102840-39-1
CAS Name: 3-(1,1-dimethoxyethyl)-1,1-dimethylcyclohexane
OPENEYE Name: 3-(1,1-dimethoxyethyl)-1,1-dimethyl-cyclohexane
IUPAC Name: 3-(1,1-dimethoxyethyl)-1,1-dimethylcyclohexane
SYSTEMATIC NAME: 3-(1,1-dimethoxyethyl)-1,1-dimethyl-cyclohexane
MOLECULAR FORMULA: C12H24O2
MOLECULAR WEIGHT: 200.31776
SMILES: CC1(CCCC(C1)C(C)(OC)OC)C
Structure:
CAS RN: 73754-27-5
CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid 2-[4-[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropoxy]-2,2,6,6-tetramethyl-1-piperidinyl]ethyl ester
OPENEYE Name: 2-[4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyloxy]-2,2,6,6-tetramethyl-1-piperidyl]ethyl 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate
IUPAC Name: 2-[4-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]-2,2,6,6-tetramethylpiperidin-1-yl]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
SYSTEMATIC NAME: 2-[4-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyloxy]-2,2,6,6-tetramethyl-piperidin-1-yl]ethyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate
MOLECULAR FORMULA: C45H71NO6
MOLECULAR WEIGHT: 722.04834
SMILES: CC1(CC(CC(N1CCOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)(C)C)OC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C
Structure:
CAS RN: 132865-53-3
CAS Name: (5-chloro-6-methoxy-3-pyridinyl)methanol
OPENEYE Name: (5-chloro-6-methoxy-3-pyridyl)methanol
IUPAC Name: (5-chloro-6-methoxypyridin-3-yl)methanol
SYSTEMATIC NAME: (5-chloranyl-6-methoxy-pyridin-3-yl)methanol
MOLECULAR FORMULA: C7H8ClNO2
MOLECULAR WEIGHT: 173.59692
SMILES: COC1=C(C=C(C=N1)CO)Cl
Structure:
CAS RN: 132865-44-2
CAS Name: 5-chloro-6-methoxy-3-pyridinecarboxaldehyde
OPENEYE Name: 5-chloro-6-methoxy-pyridine-3-carbaldehyde
IUPAC Name: 5-chloro-6-methoxypyridine-3-carbaldehyde
SYSTEMATIC NAME: 5-chloranyl-6-methoxy-pyridine-3-carbaldehyde
MOLECULAR FORMULA: C7H6ClNO2
MOLECULAR WEIGHT: 171.58104
SMILES: COC1=C(C=C(C=N1)C=O)Cl
Structure:
CAS RN: 132973-43-4
CAS Name: 4-(aminomethyl)-1H-quinolin-2-one
OPENEYE Name: 4-(aminomethyl)-1H-quinolin-2-one
IUPAC Name: 4-(aminomethyl)-1H-quinolin-2-one
SYSTEMATIC NAME: 4-(aminomethyl)-1H-quinolin-2-one
MOLECULAR FORMULA: C10H10N2O
MOLECULAR WEIGHT: 174.1992
SMILES: C1=CC=C2C(=C1)C(=CC(=O)N2)CN
Structure:
CAS RN: 104777-32-4
CAS Name: 2-bromo-1-(3-methyl-5-isoxazolyl)ethanone
OPENEYE Name: 2-bromo-1-(3-methylisoxazol-5-yl)ethanone
IUPAC Name: 2-bromo-1-(3-methyl-1,2-oxazol-5-yl)ethanone
SYSTEMATIC NAME: 2-bromanyl-1-(3-methyl-1,2-oxazol-5-yl)ethanone
MOLECULAR FORMULA: C6H6BrNO2
MOLECULAR WEIGHT: 204.02134
SMILES: CC1=NOC(=C1)C(=O)CBr
Structure:
CAS RN: 132213-03-7
CAS Name: 6-imidazo[1,2-a]pyridinylmethanamine
OPENEYE Name: imidazo[1,2-a]pyridin-6-ylmethanamine
IUPAC Name: imidazo[1,2-a]pyridin-6-ylmethanamine
SYSTEMATIC NAME: imidazo[1,2-a]pyridin-6-ylmethanamine
MOLECULAR FORMULA: C8H9N3
MOLECULAR WEIGHT: 147.17716
SMILES: C1=CC2=NC=CN2C=C1CN
Structure:
CAS RN: 6436-60-8
CAS Name: 2-methyl-4-thiazolecarboxylic acid methyl ester
OPENEYE Name: methyl 2-methylthiazole-4-carboxylate
IUPAC Name: methyl 2-methyl-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: methyl 2-methyl-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C6H7NO2S
MOLECULAR WEIGHT: 157.19028
SMILES: CC1=NC(=CS1)C(=O)OC
Structure:
No comments:
Post a Comment