CAS RN: 6935-74-6
CAS Name: diiodomethanedisulfonic acid
OPENEYE Name: diiodomethanedisulfonic acid
IUPAC Name: diiodomethanedisulfonic acid
SYSTEMATIC NAME: bis(iodanyl)methanedisulfonic acid
MOLECULAR FORMULA: CH2I2O6S2
MOLECULAR WEIGHT: 427.96192
SMILES: C(S(=O)(=O)O)(S(=O)(=O)O)(I)I
Structure:
CAS RN: 5472-60-6
CAS Name: 3,3-diethyl-10-methyl-3,6-diazoniaspiro[5.6]dodecane
OPENEYE Name: 3,3-diethyl-10-methyl-3,6-diazoniaspiro[5.6]dodecane
IUPAC Name: 3,3-diethyl-10-methyl-3,6-diazoniaspiro[5.6]dodecane
SYSTEMATIC NAME: 3,3-diethyl-10-methyl-3,6-diazoniaspiro[5.6]dodecane
MOLECULAR FORMULA: C15H32N2+2
MOLECULAR WEIGHT: 240.42798
SMILES: CC[N+]1(CC[N+]2(CCCC(CC2)C)CC1)CC
Structure:
CAS RN: 30098-65-8
CAS Name: 5,8-diazoniadispiro[4.2.4^{8}.2^{5}]tetradecane
OPENEYE Name: 5,8-diazoniadispiro[4.2.4^{8}.2^{5}]tetradecane
IUPAC Name: 5,8-diazoniadispiro[4.2.4^{8}.2^{5}]tetradecane
SYSTEMATIC NAME: 5,8-diazoniadispiro[4.2.4^{8}.2^{5}]tetradecane
MOLECULAR FORMULA: C12H24N2+2
MOLECULAR WEIGHT: 196.33236
SMILES: C1CC[N+]2(C1)CC[N+]3(CCCC3)CC2
Structure:
CAS RN: 79025-11-9
CAS Name: 1-[4-(3-methoxyphenyl)-1-methyl-4-piperidinyl]-1-propanone
OPENEYE Name: 1-[4-(3-methoxyphenyl)-1-methyl-4-piperidyl]propan-1-one
IUPAC Name: 1-[4-(3-methoxyphenyl)-1-methylpiperidin-4-yl]propan-1-one
SYSTEMATIC NAME: 1-[4-(3-methoxyphenyl)-1-methyl-piperidin-4-yl]propan-1-one
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 261.35932
SMILES: CCC(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)OC
Structure:
CAS RN: 102371-04-0
CAS Name: 2-(1-hydroxycyclohexyl)-2-phenylacetic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 2-(1-hydroxycyclohexyl)-2-phenyl-acetate
IUPAC Name: 2-(diethylamino)ethyl 2-(1-hydroxycyclohexyl)-2-phenylacetate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 2-(1-oxidanylcyclohexyl)-2-phenyl-ethanoate
MOLECULAR FORMULA: C20H31NO3
MOLECULAR WEIGHT: 333.46504
SMILES: CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2(CCCCC2)O
Structure:
CAS RN: 5467-24-3
CAS Name: 1-methyl-3-(1,2,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-methyl-3-(1,2,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-methyl-3-(1,2,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-methyl-3-(1,2,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C33H28
MOLECULAR WEIGHT: 424.57542
SMILES: CC1=CC(=CC=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 6332-71-4
CAS Name: bromo(5,5-dimethylhexyl)mercury
OPENEYE Name: bromo(5,5-dimethylhexyl)mercury
IUPAC Name: bromo(5,5-dimethylhexyl)mercury
SYSTEMATIC NAME: bromanyl(5,5-dimethylhexyl)mercury
MOLECULAR FORMULA: C8H17BrHg
MOLECULAR WEIGHT: 393.71458
SMILES: CC(C)(C)CCCC[Hg]Br
Structure:
CAS RN: 16732-73-3
CAS Name: 6-methoxy-1H-indole-2-carboxylic acid
OPENEYE Name: 6-methoxy-1H-indole-2-carboxylic acid
IUPAC Name: 6-methoxy-1H-indole-2-carboxylic acid
SYSTEMATIC NAME: 6-methoxy-1H-indole-2-carboxylic acid
MOLECULAR FORMULA: C10H9NO3
MOLECULAR WEIGHT: 191.18336
SMILES: COC1=CC2=C(C=C1)C=C(N2)C(=O)O
Structure:
CAS RN: 5470-64-4
CAS Name: 9-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydrophenanthrene
OPENEYE Name: 9-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydrophenanthrene
IUPAC Name: 9-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydrophenanthrene
SYSTEMATIC NAME: 9-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydrophenanthrene
MOLECULAR FORMULA: C40H34
MOLECULAR WEIGHT: 514.69796
SMILES: C1CCC2=C(C1)C=C(C3=CC=CC=C23)C(C4=CC=CC=C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7
Structure:
CAS RN: 6318-29-2
CAS Name: 5-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydronaphthalene
OPENEYE Name: 5-(1,2,2,2-tetraphenylethyl)tetralin
IUPAC Name: 5-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydronaphthalene
SYSTEMATIC NAME: 5-(1,2,2,2-tetraphenylethyl)-1,2,3,4-tetrahydronaphthalene
MOLECULAR FORMULA: C36H32
MOLECULAR WEIGHT: 464.63928
SMILES: C1CCC2=C(C1)C=CC=C2C(C3=CC=CC=C3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
Structure:
CAS RN: 5470-59-7
CAS Name: 1-chloro-3-(1,2,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-chloro-3-(1,2,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-chloro-3-(1,2,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-chloranyl-3-(1,2,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C32H25Cl
MOLECULAR WEIGHT: 444.9939
SMILES: C1=CC=C(C=C1)C(C2=CC(=CC=C2)Cl)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 5472-09-3
CAS Name: 1-chloro-2-(1,1,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-chloro-2-(1,1,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-chloro-2-(1,1,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-chloranyl-2-(1,1,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C32H25Cl
MOLECULAR WEIGHT: 444.9939
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5Cl
Structure:
CAS RN: 5472-08-2
CAS Name: 1-bromo-3-(1,2,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-bromo-3-(1,2,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-bromo-3-(1,2,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-bromanyl-3-(1,2,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C32H25Br
MOLECULAR WEIGHT: 489.4449
SMILES: C1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 5472-07-1
CAS Name: 1-bromo-2-(1,2,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-bromo-2-(1,2,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-bromo-2-(1,2,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-bromanyl-2-(1,2,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C32H25Br
MOLECULAR WEIGHT: 489.4449
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2Br)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 5472-34-4
CAS Name: 1-bromo-3-(1,1,2,2-tetraphenylethyl)benzene
OPENEYE Name: 1-bromo-3-(1,1,2,2-tetraphenylethyl)benzene
IUPAC Name: 1-bromo-3-(1,1,2,2-tetraphenylethyl)benzene
SYSTEMATIC NAME: 1-bromanyl-3-(1,1,2,2-tetraphenylethyl)benzene
MOLECULAR FORMULA: C32H25Br
MOLECULAR WEIGHT: 489.4449
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC(=CC=C5)Br
Structure:
CAS RN: 67724-04-3
CAS Name: 4-[(4-aminophenyl)sulfonylamino]benzenesulfonic acid
OPENEYE Name: 4-[(4-aminophenyl)sulfonylamino]benzenesulfonic acid
IUPAC Name: 4-[(4-aminophenyl)sulfonylamino]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(4-aminophenyl)sulfonylamino]benzenesulfonic acid
MOLECULAR FORMULA: C12H12N2O5S2
MOLECULAR WEIGHT: 328.36408
SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)O
Structure:
CAS RN: 4968-66-5
CAS Name: 4-[anilino(oxo)methoxy]benzenecarboximidic acid ethyl ester
OPENEYE Name: ethyl 4-(phenylcarbamoyloxy)benzenecarboximidate
IUPAC Name: ethyl 4-(phenylcarbamoyloxy)benzenecarboximidate
SYSTEMATIC NAME: ethyl 4-(phenylcarbamoyloxy)benzenecarboximidate
MOLECULAR FORMULA: C16H16N2O3
MOLECULAR WEIGHT: 284.30984
SMILES: CCOC(=N)C1=CC=C(C=C1)OC(=O)NC2=CC=CC=C2
Structure:
CAS RN: 4968-57-4
CAS Name: 2-cyclopentyl-2-phenylacetic acid 2-[methyl(propan-2-yl)amino]ethyl ester
OPENEYE Name: 2-[isopropyl(methyl)amino]ethyl 2-cyclopentyl-2-phenyl-acetate
IUPAC Name: 2-[methyl(propan-2-yl)amino]ethyl 2-cyclopentyl-2-phenylacetate
SYSTEMATIC NAME: 2-[methyl(propan-2-yl)amino]ethyl 2-cyclopentyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C19H29NO2
MOLECULAR WEIGHT: 303.43906
SMILES: CC(C)N(C)CCOC(=O)C(C1CCCC1)C2=CC=CC=C2
Structure:
CAS RN: 89614-96-0
CAS Name: 3-amino-1-cyclopentanecarboxylic acid
OPENEYE Name: 3-aminocyclopentanecarboxylic acid
IUPAC Name: 3-aminocyclopentane-1-carboxylic acid
SYSTEMATIC NAME: 3-azanylcyclopentane-1-carboxylic acid
MOLECULAR FORMULA: C6H11NO2
MOLECULAR WEIGHT: 129.15704
SMILES: C1CC(CC1C(=O)O)N
Structure:
CAS RN: 51062-15-8
CAS Name: 4-(4-methoxyphenyl)-2-butanamine
OPENEYE Name: 4-(4-methoxyphenyl)butan-2-amine
IUPAC Name: 4-(4-methoxyphenyl)butan-2-amine
SYSTEMATIC NAME: 4-(4-methoxyphenyl)butan-2-amine
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CC(CCC1=CC=C(C=C1)OC)N
Structure:
CAS RN: 66264-86-6
CAS Name: 4-(4-methoxyphenyl)-2-butanamine
OPENEYE Name: 4-(4-methoxyphenyl)butan-2-amine
IUPAC Name: 4-(4-methoxyphenyl)butan-2-amine
SYSTEMATIC NAME: 4-(4-methoxyphenyl)butan-2-amine
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CC(CCC1=CC=C(C=C1)OC)N
Structure:
CAS RN: 73790-59-7
CAS Name: 1-piperidinecarboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl piperidine-1-carboxylate
IUPAC Name: 2-(diethylamino)ethyl piperidine-1-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl piperidine-1-carboxylate
MOLECULAR FORMULA: C12H24N2O2
MOLECULAR WEIGHT: 228.33116
SMILES: CCN(CC)CCOC(=O)N1CCCCC1
Structure:
CAS RN: 5469-99-8
CAS Name: 2-(4-methylanilino)-1,1,2-triphenylethanol
OPENEYE Name: 2-(4-methylanilino)-1,1,2-triphenyl-ethanol
IUPAC Name: 2-(4-methylanilino)-1,1,2-triphenylethanol
SYSTEMATIC NAME: 2-[(4-methylphenyl)amino]-1,1,2-triphenyl-ethanol
MOLECULAR FORMULA: C27H25NO
MOLECULAR WEIGHT: 379.4935
SMILES: CC1=CC=C(C=C1)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O
Structure:
CAS RN: 5469-98-7
CAS Name: 2-cyano-3-(4-methylphenyl)imino-4,4-diphenylbutanoic acid ethyl ester
OPENEYE Name: ethyl 2-cyano-4,4-diphenyl-3-(p-tolylimino)butanoate
IUPAC Name: ethyl 2-cyano-3-(4-methylphenyl)imino-4,4-diphenylbutanoate
SYSTEMATIC NAME: ethyl 2-cyano-3-(4-methylphenyl)imino-4,4-diphenyl-butanoate
MOLECULAR FORMULA: C26H24N2O2
MOLECULAR WEIGHT: 396.48096
SMILES: CCOC(=O)C(C#N)C(=NC1=CC=C(C=C1)C)C(C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 34861-30-8
CAS Name: 2-(pyridin-4-ylamino)benzoic acid
OPENEYE Name: 2-(4-pyridylamino)benzoic acid
IUPAC Name: 2-(pyridin-4-ylamino)benzoic acid
SYSTEMATIC NAME: 2-(pyridin-4-ylamino)benzoic acid
MOLECULAR FORMULA: C12H10N2O2
MOLECULAR WEIGHT: 214.22
SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=CC=NC=C2
Structure:
CAS RN: 21901-79-1
CAS Name: 2-[hydroxy(diphenyl)methyl]-1-piperidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[hydroxy(diphenyl)methyl]piperidine-1-carboxylate
IUPAC Name: ethyl 2-[hydroxy(diphenyl)methyl]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 2-[oxidanyl(diphenyl)methyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C21H25NO3
MOLECULAR WEIGHT: 339.4281
SMILES: CCOC(=O)N1CCCCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O
Structure:
CAS RN: 6882-74-2
CAS Name: 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
OPENEYE Name: 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
IUPAC Name: 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
SYSTEMATIC NAME: 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
MOLECULAR FORMULA: C6H9N3
MOLECULAR WEIGHT: 123.15576
SMILES: C1CNCC2=C1N=CN2
Structure:
CAS RN: 6935-85-9
CAS Name: 1-hydroxy-2-propanesulfonic acid
OPENEYE Name: 1-hydroxypropane-2-sulfonic acid
IUPAC Name: 1-hydroxypropane-2-sulfonic acid
SYSTEMATIC NAME: 1-oxidanylpropane-2-sulfonic acid
MOLECULAR FORMULA: C3H8O4S
MOLECULAR WEIGHT: 140.15822
SMILES: CC(CO)S(=O)(=O)O
Structure:
CAS RN: 25655-41-8
CAS Name: 1-ethenyl-2-pyrrolidinone; molecular iodine
OPENEYE Name: molecular iodine; 1-vinylpyrrolidin-2-one
IUPAC Name: 1-ethenylpyrrolidin-2-one; molecular iodine
SYSTEMATIC NAME: 1-ethenylpyrrolidin-2-one; molecular iodine
MOLECULAR FORMULA: C6H9I2NO
MOLECULAR WEIGHT: 364.9507
SMILES: C=CN1CCCC1=O.II
Structure:
CAS RN: 5470-40-6
CAS Name: 2-(3-methylphenyl)ethanamine
OPENEYE Name: 2-(m-tolyl)ethanamine
IUPAC Name: 2-(3-methylphenyl)ethanamine
SYSTEMATIC NAME: 2-(3-methylphenyl)ethanamine
MOLECULAR FORMULA: C9H13N
MOLECULAR WEIGHT: 135.20622
SMILES: CC1=CC(=CC=C1)CCN
Structure:
CAS RN: 17283-14-6
CAS Name: 2-(3,4-dimethylphenyl)ethanamine
OPENEYE Name: 2-(3,4-dimethylphenyl)ethanamine
IUPAC Name: 2-(3,4-dimethylphenyl)ethanamine
SYSTEMATIC NAME: 2-(3,4-dimethylphenyl)ethanamine
MOLECULAR FORMULA: C10H15N
MOLECULAR WEIGHT: 149.2328
SMILES: CC1=C(C=C(C=C1)CCN)C
Structure:
CAS RN: 15793-48-3
CAS Name: 5-chloro-2-ethoxyaniline
OPENEYE Name: 5-chloro-2-ethoxy-aniline
IUPAC Name: 5-chloro-2-ethoxyaniline
SYSTEMATIC NAME: 5-chloranyl-2-ethoxy-aniline
MOLECULAR FORMULA: C8H10ClNO
MOLECULAR WEIGHT: 171.6241
SMILES: CCOC1=C(C=C(C=C1)Cl)N
Structure:
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