CAS RN: 38201-66-0
CAS Name: 3,7-bis(2-phenylpropan-2-yl)-10H-phenothiazine
OPENEYE Name: 3,7-bis(1-methyl-1-phenyl-ethyl)-10H-phenothiazine
IUPAC Name: 3,7-bis(2-phenylpropan-2-yl)-10H-phenothiazine
SYSTEMATIC NAME: 3,7-bis(2-phenylpropan-2-yl)-10H-phenothiazine
MOLECULAR FORMULA: C30H29NS
MOLECULAR WEIGHT: 435.62296
SMILES: CC(C)(C1=CC=CC=C1)C2=CC3=C(C=C2)NC4=C(S3)C=C(C=C4)C(C)(C)C5=CC=CC=C5
Structure:
CAS RN: 38160-52-0
CAS Name: 3-(dodecylthio)propanal
OPENEYE Name: 3-dodecylsulfanylpropanal
IUPAC Name: 3-dodecylsulfanylpropanal
SYSTEMATIC NAME: 3-dodecylsulfanylpropanal
MOLECULAR FORMULA: C15H30OS
MOLECULAR WEIGHT: 258.4631
SMILES: CCCCCCCCCCCCSCCC=O
Structure:
CAS RN: 38135-56-7
CAS Name: 3-phenyl-1-butanamine
OPENEYE Name: 3-phenylbutan-1-amine
IUPAC Name: 3-phenylbutan-1-amine
SYSTEMATIC NAME: 3-phenylbutan-1-amine
MOLECULAR FORMULA: C10H15N
MOLECULAR WEIGHT: 149.2328
SMILES: CC(CCN)C1=CC=CC=C1
Structure:
CAS RN: 38098-46-3
CAS Name: 1-mercaptopropane-1,1-diol
OPENEYE Name: 1-sulfanylpropane-1,1-diol
IUPAC Name: 1-sulfanylpropane-1,1-diol
SYSTEMATIC NAME: 1-sulfanylpropane-1,1-diol
MOLECULAR FORMULA: C3H8O2S
MOLECULAR WEIGHT: 108.15942
SMILES: CCC(O)(O)S
Structure:
CAS RN: 38059-43-7
CAS Name: 2-methyl-6-propyl-3-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-methyl-6-propyl-pyridine-3-carboxylate
IUPAC Name: ethyl 2-methyl-6-propylpyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-methyl-6-propyl-pyridine-3-carboxylate
MOLECULAR FORMULA: C12H17NO2
MOLECULAR WEIGHT: 207.26888
SMILES: CCCC1=NC(=C(C=C1)C(=O)OCC)C
Structure:
CAS RN: 38050-97-4
CAS Name: 4-[[4-[bis(4-hydroxyphenyl)-phenylmethyl]phenyl]-(4-hydroxyphenyl)-phenylmethyl]phenol
OPENEYE Name: 4-[[4-[bis(4-hydroxyphenyl)-phenyl-methyl]phenyl]-(4-hydroxyphenyl)-phenyl-methyl]phenol
IUPAC Name: 4-[[4-[bis(4-hydroxyphenyl)-phenylmethyl]phenyl]-(4-hydroxyphenyl)-phenylmethyl]phenol
SYSTEMATIC NAME: 4-[[4-[bis(4-hydroxyphenyl)-phenyl-methyl]phenyl]-(4-hydroxyphenyl)-phenyl-methyl]phenol
MOLECULAR FORMULA: C44H34O4
MOLECULAR WEIGHT: 626.73836
SMILES: C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C3=CC=CC=C3)(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)(C6=CC=C(C=C6)O)C7=CC=C(C=C7)O
Structure:
CAS RN: 38005-82-2
CAS Name: 2,3-dihydro-1H-indene-1,5-diol
OPENEYE Name: indane-1,5-diol
IUPAC Name: 2,3-dihydro-1H-indene-1,5-diol
SYSTEMATIC NAME: 2,3-dihydro-1H-indene-1,5-diol
MOLECULAR FORMULA: C9H10O2
MOLECULAR WEIGHT: 150.1745
SMILES: C1CC2=C(C1O)C=CC(=C2)O
Structure:
CAS RN: 38004-22-7
CAS Name: acetic acid (1-acetyl-5-methyl-3-pyrazolyl) ester
OPENEYE Name: (1-acetyl-5-methyl-pyrazol-3-yl) acetate
IUPAC Name: (1-acetyl-5-methylpyrazol-3-yl) acetate
SYSTEMATIC NAME: (1-ethanoyl-5-methyl-pyrazol-3-yl) ethanoate
MOLECULAR FORMULA: C8H10N2O3
MOLECULAR WEIGHT: 182.1766
SMILES: CC1=CC(=NN1C(=O)C)OC(=O)C
Structure:
CAS RN: 38004-08-9
CAS Name: N-(2-ethoxyethyl)aniline
OPENEYE Name: N-(2-ethoxyethyl)aniline
IUPAC Name: N-(2-ethoxyethyl)aniline
SYSTEMATIC NAME: N-(2-ethoxyethyl)aniline
MOLECULAR FORMULA: C10H15NO
MOLECULAR WEIGHT: 165.2322
SMILES: CCOCCNC1=CC=CC=C1
Structure:
CAS RN: 37981-16-1
CAS Name: cyclohex-4-ene-1,2-dicarboxylic acid dibutyl ester
OPENEYE Name: dibutyl cyclohex-4-ene-1,2-dicarboxylate
IUPAC Name: dibutyl cyclohex-4-ene-1,2-dicarboxylate
SYSTEMATIC NAME: dibutyl cyclohex-4-ene-1,2-dicarboxylate
MOLECULAR FORMULA: C16H26O4
MOLECULAR WEIGHT: 282.37524
SMILES: CCCCOC(=O)C1CC=CCC1C(=O)OCCCC
Structure:
CAS RN: 37981-14-9
CAS Name: 1-cyclohex-3-enecarboxylic acid butyl ester
OPENEYE Name: butyl cyclohex-3-ene-1-carboxylate
IUPAC Name: butyl cyclohex-3-ene-1-carboxylate
SYSTEMATIC NAME: butyl cyclohex-3-ene-1-carboxylate
MOLECULAR FORMULA: C11H18O2
MOLECULAR WEIGHT: 182.25942
SMILES: CCCCOC(=O)C1CCC=CC1
Structure:
CAS RN: 37901-92-1
CAS Name: 4-acetamido-3-methylbenzoic acid
OPENEYE Name: 4-acetamido-3-methyl-benzoic acid
IUPAC Name: 4-acetamido-3-methylbenzoic acid
SYSTEMATIC NAME: 4-acetamido-3-methyl-benzoic acid
MOLECULAR FORMULA: C10H11NO3
MOLECULAR WEIGHT: 193.19924
SMILES: CC1=C(C=CC(=C1)C(=O)O)NC(=O)C
Structure:
CAS RN: 37837-69-7
CAS Name: 1,2,3,4-tetrahydronaphthalene-1-sulfonic acid
OPENEYE Name: tetralin-1-sulfonic acid
IUPAC Name: 1,2,3,4-tetrahydronaphthalene-1-sulfonic acid
SYSTEMATIC NAME: 1,2,3,4-tetrahydronaphthalene-1-sulfonic acid
MOLECULAR FORMULA: C10H12O3S
MOLECULAR WEIGHT: 212.26548
SMILES: C1CC(C2=CC=CC=C2C1)S(=O)(=O)O
Structure:
CAS RN: 37832-34-1
CAS Name: 1,4-bis(dimethoxymethyl)benzene
OPENEYE Name: 1,4-bis(dimethoxymethyl)benzene
IUPAC Name: 1,4-bis(dimethoxymethyl)benzene
SYSTEMATIC NAME: 1,4-bis(dimethoxymethyl)benzene
MOLECULAR FORMULA: C12H18O4
MOLECULAR WEIGHT: 226.26892
SMILES: COC(C1=CC=C(C=C1)C(OC)OC)OC
Structure:
CAS RN: 37794-15-3
CAS Name: 4-methylsulfinylbenzaldehyde
OPENEYE Name: 4-methylsulfinylbenzaldehyde
IUPAC Name: 4-methylsulfinylbenzaldehyde
SYSTEMATIC NAME: 4-methylsulfinylbenzaldehyde
MOLECULAR FORMULA: C8H8O2S
MOLECULAR WEIGHT: 168.21292
SMILES: CS(=O)C1=CC=C(C=C1)C=O
Structure:
CAS RN: 37784-67-1
CAS Name: 2-(3-thiophenyl)propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(3-thienyl)propanedioate
IUPAC Name: diethyl 2-thiophen-3-ylpropanedioate
SYSTEMATIC NAME: diethyl 2-thiophen-3-ylpropanedioate
MOLECULAR FORMULA: C11H14O4S
MOLECULAR WEIGHT: 242.29146
SMILES: CCOC(=O)C(C1=CSC=C1)C(=O)OCC
Structure:
CAS RN: 37782-46-0
CAS Name: (1-ethyl-2-piperidinyl)methanamine
OPENEYE Name: (1-ethyl-2-piperidyl)methanamine
IUPAC Name: (1-ethylpiperidin-2-yl)methanamine
SYSTEMATIC NAME: (1-ethylpiperidin-2-yl)methanamine
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CCN1CCCCC1CN
Structure:
CAS RN: 37762-97-3
CAS Name: 1-(4-methyl-2-thiazolyl)-2-pyrrolidinone
OPENEYE Name: 1-(4-methylthiazol-2-yl)pyrrolidin-2-one
IUPAC Name: 1-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-2-one
MOLECULAR FORMULA: C8H10N2OS
MOLECULAR WEIGHT: 182.2428
SMILES: CC1=CSC(=N1)N2CCCC2=O
Structure:
CAS RN: 37734-89-7
CAS Name: 2-phenyl-1-(phenylmethyl)imidazole
OPENEYE Name: 1-benzyl-2-phenyl-imidazole
IUPAC Name: 1-benzyl-2-phenylimidazole
SYSTEMATIC NAME: 2-phenyl-1-(phenylmethyl)imidazole
MOLECULAR FORMULA: C16H14N2
MOLECULAR WEIGHT: 234.29576
SMILES: C1=CC=C(C=C1)CN2C=CN=C2C3=CC=CC=C3
Structure:
CAS RN: 37718-11-9
CAS Name: 1H-pyrazole-4-carboxylic acid
OPENEYE Name: 1H-pyrazole-4-carboxylic acid
IUPAC Name: 1H-pyrazole-4-carboxylic acid
SYSTEMATIC NAME: 1H-pyrazole-4-carboxylic acid
MOLECULAR FORMULA: C4H4N2O2
MOLECULAR WEIGHT: 112.08676
SMILES: C1=C(C=NN1)C(=O)O
Structure:
CAS RN: 37699-28-8
CAS Name: 2-bromo-1-(4-chloro-3,5-dinitrophenyl)ethanone
OPENEYE Name: 2-bromo-1-(4-chloro-3,5-dinitro-phenyl)ethanone
IUPAC Name: 2-bromo-1-(4-chloro-3,5-dinitrophenyl)ethanone
SYSTEMATIC NAME: 2-bromanyl-1-(4-chloranyl-3,5-dinitro-phenyl)ethanone
MOLECULAR FORMULA: C8H4BrClN2O5
MOLECULAR WEIGHT: 323.48476
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)CBr
Structure:
CAS RN: 37693-15-5
CAS Name: 2,6-dichloro-3-methyl-4-nitrophenol
OPENEYE Name: 2,6-dichloro-3-methyl-4-nitro-phenol
IUPAC Name: 2,6-dichloro-3-methyl-4-nitrophenol
SYSTEMATIC NAME: 2,6-bis(chloranyl)-3-methyl-4-nitro-phenol
MOLECULAR FORMULA: C7H5Cl2NO3
MOLECULAR WEIGHT: 222.0255
SMILES: CC1=C(C(=C(C=C1[N+](=O)[O-])Cl)O)Cl
Structure:
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