CAS RN: 6335-66-6
CAS Name: 2-formamido-3-mercapto-3-methylbutanoic acid
OPENEYE Name: 2-formamido-3-methyl-3-sulfanyl-butanoic acid
IUPAC Name: 2-formamido-3-methyl-3-sulfanylbutanoic acid
SYSTEMATIC NAME: 2-formamido-3-methyl-3-sulfanyl-butanoic acid
MOLECULAR FORMULA: C6H11NO3S
MOLECULAR WEIGHT: 177.22144
SMILES: CC(C)(C(C(=O)O)NC=O)S
Structure:
CAS RN: 88744-17-6
CAS Name: 2-[(1-oxo-2-phenylethyl)amino]propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-[(2-phenylacetyl)amino]propanedioate
IUPAC Name: diethyl 2-[(2-phenylacetyl)amino]propanedioate
SYSTEMATIC NAME: diethyl 2-(2-phenylethanoylamino)propanedioate
MOLECULAR FORMULA: C15H19NO5
MOLECULAR WEIGHT: 293.31506
SMILES: CCOC(=O)C(C(=O)OCC)NC(=O)CC1=CC=CC=C1
Structure:
CAS RN: 2443-68-7
CAS Name: N-(2-hydrazinyl-2-oxoethyl)benzamide
OPENEYE Name: N-(2-hydrazino-2-oxo-ethyl)benzamide
IUPAC Name: N-(2-hydrazinyl-2-oxoethyl)benzamide
SYSTEMATIC NAME: N-(2-diazanyl-2-oxidanylidene-ethyl)benzamide
MOLECULAR FORMULA: C9H11N3O2
MOLECULAR WEIGHT: 193.20254
SMILES: C1=CC=C(C=C1)C(=O)NCC(=O)NN
Structure:
CAS RN: 66267-61-6
CAS Name: 2-hydroxy-2-phenylacetic acid 5-ethylnonan-2-yl ester
OPENEYE Name: (4-ethyl-1-methyl-octyl) 2-hydroxy-2-phenyl-acetate
IUPAC Name: 5-ethylnonan-2-yl 2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: 5-ethylnonan-2-yl 2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C19H30O3
MOLECULAR WEIGHT: 306.4397
SMILES: CCCCC(CC)CCC(C)OC(=O)C(C1=CC=CC=C1)O
Structure:
CAS RN: 159-48-8
CAS Name: spiro[9H-anthracene-10,9'-xanthene]
OPENEYE Name: spiro[9H-anthracene-10,9'-xanthene]
IUPAC Name: spiro[9H-anthracene-10,9'-xanthene]
SYSTEMATIC NAME: spiro[9H-anthracene-10,9'-xanthene]
MOLECULAR FORMULA: C26H18O
MOLECULAR WEIGHT: 346.42052
SMILES: C1C2=CC=CC=C2C3(C4=CC=CC=C41)C5=CC=CC=C5OC6=CC=CC=C36
Structure:
CAS RN: 67635-27-2
CAS Name: 9-(triphenylmethyl)-9H-fluorene
OPENEYE Name: 9-trityl-9H-fluorene
IUPAC Name: 9-trityl-9H-fluorene
SYSTEMATIC NAME: 9-(triphenylmethyl)-9H-fluorene
MOLECULAR FORMULA: C32H24
MOLECULAR WEIGHT: 408.53296
SMILES: C1=CC=C(C=C1)C(C2C3=CC=CC=C3C4=CC=CC=C24)(C5=CC=CC=C5)C6=CC=CC=C6
Structure:
CAS RN: 20308-46-7
CAS Name: N,N-dibutyl-2-chlorobenzamide
OPENEYE Name: N,N-dibutyl-2-chloro-benzamide
IUPAC Name: N,N-dibutyl-2-chlorobenzamide
SYSTEMATIC NAME: N,N-dibutyl-2-chloranyl-benzamide
MOLECULAR FORMULA: C15H22ClNO
MOLECULAR WEIGHT: 267.79428
SMILES: CCCCN(CCCC)C(=O)C1=CC=CC=C1Cl
Structure:
CAS RN: 15437-13-5
CAS Name: 4-ethoxy-N-phenylbenzamide
OPENEYE Name: 4-ethoxy-N-phenyl-benzamide
IUPAC Name: 4-ethoxy-N-phenylbenzamide
SYSTEMATIC NAME: 4-ethoxy-N-phenyl-benzamide
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: CCOC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2
Structure:
CAS RN: 4102-92-5
CAS Name: benzoic acid (2-methyl-4,6-dinitrophenyl) ester
OPENEYE Name: (2-methyl-4,6-dinitro-phenyl) benzoate
IUPAC Name: (2-methyl-4,6-dinitrophenyl) benzoate
SYSTEMATIC NAME: (2-methyl-4,6-dinitro-phenyl) benzoate
MOLECULAR FORMULA: C14H10N2O6
MOLECULAR WEIGHT: 302.239
SMILES: CC1=CC(=CC(=C1OC(=O)C2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 20308-44-5
CAS Name: N-(3-methoxypropyl)benzamide
OPENEYE Name: N-(3-methoxypropyl)benzamide
IUPAC Name: N-(3-methoxypropyl)benzamide
SYSTEMATIC NAME: N-(3-methoxypropyl)benzamide
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: COCCCNC(=O)C1=CC=CC=C1
Structure:
CAS RN: 3197-19-1
CAS Name: N-[3-(dimethylamino)propyl]acetamide
OPENEYE Name: N-[3-(dimethylamino)propyl]acetamide
IUPAC Name: N-[3-(dimethylamino)propyl]acetamide
SYSTEMATIC NAME: N-[3-(dimethylamino)propyl]ethanamide
MOLECULAR FORMULA: C7H16N2O
MOLECULAR WEIGHT: 144.21474
SMILES: CC(=O)NCCCN(C)C
Structure:
CAS RN: 16339-54-1
CAS Name: N-(3-methoxypropyl)acetamide
OPENEYE Name: N-(3-methoxypropyl)acetamide
IUPAC Name: N-(3-methoxypropyl)acetamide
SYSTEMATIC NAME: N-(3-methoxypropyl)ethanamide
MOLECULAR FORMULA: C6H13NO2
MOLECULAR WEIGHT: 131.17292
SMILES: CC(=O)NCCCOC
Structure:
CAS RN: 71172-42-4
CAS Name: N-(3-methoxypropyl)formamide
OPENEYE Name: N-(3-methoxypropyl)formamide
IUPAC Name: N-(3-methoxypropyl)formamide
SYSTEMATIC NAME: N-(3-methoxypropyl)methanamide
MOLECULAR FORMULA: C5H11NO2
MOLECULAR WEIGHT: 117.14634
SMILES: COCCCNC=O
Structure:
CAS RN: 56521-84-7
CAS Name: 2-bromoacetic acid 1-phenoxypropan-2-yl ester
OPENEYE Name: (1-methyl-2-phenoxy-ethyl) 2-bromoacetate
IUPAC Name: 1-phenoxypropan-2-yl 2-bromoacetate
SYSTEMATIC NAME: 1-phenoxypropan-2-yl 2-bromanylethanoate
MOLECULAR FORMULA: C11H13BrO3
MOLECULAR WEIGHT: 273.12312
SMILES: CC(COC1=CC=CC=C1)OC(=O)CBr
Structure:
CAS RN: 55704-51-3
CAS Name: 2-chloroacetic acid (4-chlorophenyl)methyl ester
OPENEYE Name: (4-chlorophenyl)methyl 2-chloroacetate
IUPAC Name: (4-chlorophenyl)methyl 2-chloroacetate
SYSTEMATIC NAME: (4-chlorophenyl)methyl 2-chloranylethanoate
MOLECULAR FORMULA: C9H8Cl2O2
MOLECULAR WEIGHT: 219.06462
SMILES: C1=CC(=CC=C1COC(=O)CCl)Cl
Structure:
CAS RN: 56521-75-6
CAS Name: 2-bromoacetic acid 1-methoxypropan-2-yl ester
OPENEYE Name: (2-methoxy-1-methyl-ethyl) 2-bromoacetate
IUPAC Name: 1-methoxypropan-2-yl 2-bromoacetate
SYSTEMATIC NAME: 1-methoxypropan-2-yl 2-bromanylethanoate
MOLECULAR FORMULA: C6H11BrO3
MOLECULAR WEIGHT: 211.05374
SMILES: CC(COC)OC(=O)CBr
Structure:
CAS RN: 20634-62-2
CAS Name: 10-undecenoic acid prop-2-ynyl ester
OPENEYE Name: prop-2-ynyl undec-10-enoate
IUPAC Name: prop-2-ynyl undec-10-enoate
SYSTEMATIC NAME: prop-2-ynyl undec-10-enoate
MOLECULAR FORMULA: C14H22O2
MOLECULAR WEIGHT: 222.32328
SMILES: C=CCCCCCCCCC(=O)OCC#C
Structure:
CAS RN: 19336-94-8
CAS Name: 2-[(3-hydroxyanilino)-oxomethyl]benzoic acid
OPENEYE Name: 2-[(3-hydroxyphenyl)carbamoyl]benzoic acid
IUPAC Name: 2-[(3-hydroxyphenyl)carbamoyl]benzoic acid
SYSTEMATIC NAME: 2-[(3-hydroxyphenyl)carbamoyl]benzoic acid
MOLECULAR FORMULA: C14H11NO4
MOLECULAR WEIGHT: 257.24144
SMILES: C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)O)C(=O)O
Structure:
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