CAS RN: 70936-96-8
CAS Name: 1-cyclopentyl-N1',N1'-dimethylethane-1,1-diamine
OPENEYE Name: 1-cyclopentyl-N1',N1'-dimethyl-ethane-1,1-diamine
IUPAC Name: 1-cyclopentyl-1-N',1-N'-dimethylethane-1,1-diamine
SYSTEMATIC NAME: 1-cyclopentyl-N1',N1'-dimethyl-ethane-1,1-diamine
MOLECULAR FORMULA: C9H20N2
MOLECULAR WEIGHT: 156.2685
SMILES: CC(C1CCCC1)(N)N(C)C
CAS RN: 29004-87-3
CAS Name: 2-hydroxy-13-methylpentadecanoic acid
OPENEYE Name: 2-hydroxy-13-methyl-pentadecanoic acid
IUPAC Name: 2-hydroxy-13-methylpentadecanoic acid
SYSTEMATIC NAME: 13-methyl-2-oxidanyl-pentadecanoic acid
MOLECULAR FORMULA: C16H32O3
MOLECULAR WEIGHT: 272.42348
SMILES: CCC(C)CCCCCCCCCCC(C(=O)O)O
CAS RN: 84254-96-6
CAS Name: dioxido(dipropoxy)silane
OPENEYE Name: dioxido(dipropoxy)silane
IUPAC Name: dioxido(dipropoxy)silane
SYSTEMATIC NAME: bis(oxidanidyl)-dipropoxy-silane
MOLECULAR FORMULA: C6H14O4Si-2
MOLECULAR WEIGHT: 178.25846
SMILES: CCCO[Si]([O-])([O-])OCCC
CAS RN: 75559-09-0
CAS Name: hydrogen sulfite; platinum(2+); hydrate
OPENEYE Name: hydrogen sulfite; platinum(2+); hydrate
IUPAC Name: hydrogen sulfite; platinum(2+); hydrate
SYSTEMATIC NAME: hydrogen sulfite; platinum(2+); hydrate
MOLECULAR FORMULA: H3O4PtS+
MOLECULAR WEIGHT: 294.16442
SMILES: O.OS(=O)[O-].[Pt+2]
CAS RN: 10311-15-6
CAS Name: 1,1,1,10-tetrachlorodecane
OPENEYE Name: 1,1,1,10-tetrachlorodecane
IUPAC Name: 1,1,1,10-tetrachlorodecane
SYSTEMATIC NAME: 1,1,1,10-tetrakis(chloranyl)decane
MOLECULAR FORMULA: C10H18Cl4
MOLECULAR WEIGHT: 280.06192
SMILES: C(CCCCC(Cl)(Cl)Cl)CCCCCl
CAS RN: 53466-90-3
CAS Name: [chloro-(2,3-dichlorophenyl)methyl]-dodecyl-dimethylammonium chloride
OPENEYE Name: [chloro-(2,3-dichlorophenyl)methyl]-dodecyl-dimethyl-ammonium chloride
IUPAC Name: [chloro-(2,3-dichlorophenyl)methyl]-dodecyl-dimethylazanium chloride
SYSTEMATIC NAME: [[2,3-bis(chloranyl)phenyl]-chloranyl-methyl]-dodecyl-dimethyl-azanium chloride
MOLECULAR FORMULA: C21H35Cl4N
MOLECULAR WEIGHT: 443.3213
SMILES: CCCCCCCCCCCC[N+](C)(C)C(C1=C(C(=CC=C1)Cl)Cl)Cl.[Cl-]
CAS RN: 54847-25-5
CAS Name: antimony silicate
OPENEYE Name: antimony silicate
IUPAC Name: antimony silicate
SYSTEMATIC NAME: antimony silicate
MOLECULAR FORMULA: O4SbSi-4
MOLECULAR WEIGHT: 213.8431
SMILES: [O-][Si]([O-])([O-])[O-].[Sb]
CAS RN: 4268-37-5
CAS Name: 1-[2-(4-aminophenyl)ethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester phosphate
OPENEYE Name: ethyl 1-[2-(4-aminophenyl)ethyl]-4-phenyl-piperidine-4-carboxylate phosphate
IUPAC Name: ethyl 1-[2-(4-aminophenyl)ethyl]-4-phenylpiperidine-4-carboxylate phosphate
SYSTEMATIC NAME: ethyl 1-[2-(4-aminophenyl)ethyl]-4-phenyl-piperidine-4-carboxylate phosphate
MOLECULAR FORMULA: C22H28N2O6P-3
MOLECULAR WEIGHT: 447.441281
SMILES: CCOC(=O)C1(CCN(CC1)CCC2=CC=C(C=C2)N)C3=CC=CC=C3.[O-]P(=O)([O-])[O-]
CAS RN: 14859-12-2
CAS Name: potassium 1-(2-nitro-1-phenylpropyl)piperazine
OPENEYE Name: potassium 1-(2-nitro-1-phenyl-propyl)piperazine
IUPAC Name: potassium 1-(2-nitro-1-phenylpropyl)piperazine
SYSTEMATIC NAME: potassium 1-(2-nitro-1-phenyl-propyl)piperazine
MOLECULAR FORMULA: C13H19KN3O2+
MOLECULAR WEIGHT: 288.40716
SMILES: CC(C(C1=CC=CC=C1)N2CCNCC2)[N+](=O)[O-].[K+]
CAS RN: 83588-44-7
CAS Name: 2-octoxythiazole
OPENEYE Name: 2-octoxythiazole
IUPAC Name: 2-octoxy-1,3-thiazole
SYSTEMATIC NAME: 2-octoxy-1,3-thiazole
MOLECULAR FORMULA: C11H19NOS
MOLECULAR WEIGHT: 213.33966
SMILES: CCCCCCCCOC1=NC=CS1
CAS RN: 28522-17-0
CAS Name: krypton-76
OPENEYE Name: krypton-76
IUPAC Name: krypton-76
SYSTEMATIC NAME: krypton-76
MOLECULAR FORMULA: Kr
MOLECULAR WEIGHT: 75.925948
SMILES: [76Kr]
CAS RN: 25544-35-8
CAS Name: 2-hydroxy-14-methylhexadecanoic acid
OPENEYE Name: 2-hydroxy-14-methyl-hexadecanoic acid
IUPAC Name: 2-hydroxy-14-methylhexadecanoic acid
SYSTEMATIC NAME: 14-methyl-2-oxidanyl-hexadecanoic acid
MOLECULAR FORMULA: C17H34O3
MOLECULAR WEIGHT: 286.45006
SMILES: CCC(C)CCCCCCCCCCCC(C(=O)O)O
CAS RN: 103339-60-2
CAS Name: 2,4-dichloro-1-cyclobut-2-enone
OPENEYE Name: 2,4-dichlorocyclobut-2-en-1-one
IUPAC Name: 2,4-dichlorocyclobut-2-en-1-one
SYSTEMATIC NAME: 2,4-bis(chloranyl)cyclobut-2-en-1-one
MOLECULAR FORMULA: C4H2Cl2O
MOLECULAR WEIGHT: 136.96408
SMILES: C1=C(C(=O)C1Cl)Cl
CAS RN: 336111-17-2
CAS Name: (E)-3-(2-chlorophenyl)-2-formamido-2-propenoic acid ethyl ester
OPENEYE Name: ethyl (E)-3-(2-chlorophenyl)-2-formamido-prop-2-enoate
IUPAC Name: ethyl (E)-3-(2-chlorophenyl)-2-formamidoprop-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-(2-chlorophenyl)-2-formamido-prop-2-enoate
MOLECULAR FORMULA: C12H12ClNO3
MOLECULAR WEIGHT: 253.68158
SMILES: CCOC(=O)/C(=C\C1=CC=CC=C1Cl)/NC=O
CAS RN: 14391-70-9
CAS Name: lanthanum-134
OPENEYE Name: lanthanum-134
IUPAC Name: lanthanum-134
SYSTEMATIC NAME: lanthanum-134
MOLECULAR FORMULA: La
MOLECULAR WEIGHT: 133.90849
SMILES: [134La]
CAS RN: 122751-78-4
CAS Name: 2-hydroxy-15-methylheptadecanoic acid
OPENEYE Name: 2-hydroxy-15-methyl-heptadecanoic acid
IUPAC Name: 2-hydroxy-15-methylheptadecanoic acid
SYSTEMATIC NAME: 15-methyl-2-oxidanyl-heptadecanoic acid
MOLECULAR FORMULA: C18H36O3
MOLECULAR WEIGHT: 300.47664
SMILES: CCC(C)CCCCCCCCCCCCC(C(=O)O)O
CAS RN: 108121-78-4
CAS Name: 2-methyl-9H-fluorene-1-carboxaldehyde
OPENEYE Name: 2-methyl-9H-fluorene-1-carbaldehyde
IUPAC Name: 2-methyl-9H-fluorene-1-carbaldehyde
SYSTEMATIC NAME: 2-methyl-9H-fluorene-1-carbaldehyde
MOLECULAR FORMULA: C15H12O
MOLECULAR WEIGHT: 208.25518
SMILES: CC1=C(C2=C(C=C1)C3=CC=CC=C3C2)C=O
CAS RN: 108544-89-4
CAS Name: 1,5-dichloro-3-(chloromethoxy)-2-methoxybenzene
OPENEYE Name: 1,5-dichloro-3-(chloromethoxy)-2-methoxy-benzene
IUPAC Name: 1,5-dichloro-3-(chloromethoxy)-2-methoxybenzene
SYSTEMATIC NAME: 1,5-bis(chloranyl)-3-(chloromethyloxy)-2-methoxy-benzene
MOLECULAR FORMULA: C8H7Cl3O2
MOLECULAR WEIGHT: 241.49898
SMILES: COC1=C(C=C(C=C1OCCl)Cl)Cl
CAS RN: 22232-26-4
CAS Name: cyclopentanecarboxylate; dodecyl-dimethyl-(phenylmethyl)ammonium
OPENEYE Name: benzyl-dodecyl-dimethyl-ammonium; cyclopentanecarboxylate
IUPAC Name: benzyl-dodecyl-dimethylazanium; cyclopentanecarboxylate
SYSTEMATIC NAME: cyclopentanecarboxylate; dodecyl-dimethyl-(phenylmethyl)azanium
MOLECULAR FORMULA: C27H47NO2
MOLECULAR WEIGHT: 417.66758
SMILES: CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C1CCC(C1)C(=O)[O-]
CAS RN: 69948-29-4
CAS Name: 1-(difluoromethoxy)-1,1-difluoroethane
OPENEYE Name: 1-(difluoromethoxy)-1,1-difluoro-ethane
IUPAC Name: 1-(difluoromethoxy)-1,1-difluoroethane
SYSTEMATIC NAME: 1-[bis(fluoranyl)methoxy]-1,1-bis(fluoranyl)ethane
MOLECULAR FORMULA: C3H4F4O
MOLECULAR WEIGHT: 132.056873
SMILES: CC(OC(F)F)(F)F
CAS RN: 116212-01-2
CAS Name: 1-nitro-2-chrysenol
OPENEYE Name: 1-nitrochrysen-2-ol
IUPAC Name: 1-nitrochrysen-2-ol
SYSTEMATIC NAME: 1-nitrochrysen-2-ol
MOLECULAR FORMULA: C18H11NO3
MOLECULAR WEIGHT: 289.28484
SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC(=C4[N+](=O)[O-])O
CAS RN: 14769-09-6
CAS Name: 2-(4-nitrophenyl)sulfonylpropanoate
OPENEYE Name: 2-(4-nitrophenyl)sulfonylpropanoate
IUPAC Name: 2-(4-nitrophenyl)sulfonylpropanoate
SYSTEMATIC NAME: 2-(4-nitrophenyl)sulfonylpropanoate
MOLECULAR FORMULA: C9H8NO6S-
MOLECULAR WEIGHT: 258.22792
SMILES: CC(C(=O)[O-])S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]
CAS RN: 87796-18-7
CAS Name: sodium 9,10-dibromo-2-anthracenesulfonic acid
OPENEYE Name: sodium 9,10-dibromoanthracene-2-sulfonic acid
IUPAC Name: sodium 9,10-dibromoanthracene-2-sulfonic acid
SYSTEMATIC NAME: sodium 9,10-bis(bromanyl)anthracene-2-sulfonic acid
MOLECULAR FORMULA: C14H8Br2NaO3S+
MOLECULAR WEIGHT: 439.07429
SMILES: C1=CC=C2C(=C1)C(=C3C=CC(=CC3=C2Br)S(=O)(=O)O)Br.[Na+]
CAS RN: 20816-28-8
CAS Name: 6,7-dihydroxy-3-(4-hydroxyphenyl)-1-benzopyran-4-one triacetate
OPENEYE Name: 6,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one triacetate
IUPAC Name: 6,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one triacetate
SYSTEMATIC NAME: 3-(4-hydroxyphenyl)-6,7-bis(oxidanyl)chromen-4-one triethanoate
MOLECULAR FORMULA: C21H19O11-3
MOLECULAR WEIGHT: 447.36896
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C1=CC(=CC=C1C2=COC3=CC(=C(C=C3C2=O)O)O)O
CAS RN: 82010-76-2
CAS Name: 1,1,1-triiodo-2-propanol
OPENEYE Name: 1,1,1-triiodopropan-2-ol
IUPAC Name: 1,1,1-triiodopropan-2-ol
SYSTEMATIC NAME: 1,1,1-tris(iodanyl)propan-2-ol
MOLECULAR FORMULA: C3H5I3O
MOLECULAR WEIGHT: 437.78461
SMILES: CC(C(I)(I)I)O
CAS RN: 108544-93-0
CAS Name: 1,2-dichloro-3,4,5-trimethoxybenzene
OPENEYE Name: 1,2-dichloro-3,4,5-trimethoxy-benzene
IUPAC Name: 1,2-dichloro-3,4,5-trimethoxybenzene
SYSTEMATIC NAME: 1,2-bis(chloranyl)-3,4,5-trimethoxy-benzene
MOLECULAR FORMULA: C9H10Cl2O3
MOLECULAR WEIGHT: 237.0799
SMILES: COC1=CC(=C(C(=C1OC)OC)Cl)Cl
CAS RN: 116211-97-3
CAS Name: 3-nitro-4-phenylbenzene-1,2-diol
OPENEYE Name: 3-nitro-4-phenyl-benzene-1,2-diol
IUPAC Name: 3-nitro-4-phenylbenzene-1,2-diol
SYSTEMATIC NAME: 3-nitro-4-phenyl-benzene-1,2-diol
MOLECULAR FORMULA: C12H9NO4
MOLECULAR WEIGHT: 231.20416
SMILES: C1=CC=C(C=C1)C2=C(C(=C(C=C2)O)O)[N+](=O)[O-]
CAS RN: 24271-19-0
CAS Name: 4-(9,9-dimethyldecyl)benzenesulfonic acid
OPENEYE Name: 4-(9,9-dimethyldecyl)benzenesulfonic acid
IUPAC Name: 4-(9,9-dimethyldecyl)benzenesulfonic acid
SYSTEMATIC NAME: 4-(9,9-dimethyldecyl)benzenesulfonic acid
MOLECULAR FORMULA: C18H30O3S
MOLECULAR WEIGHT: 326.494
SMILES: CC(C)(C)CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O
CAS RN: 21784-78-1
CAS Name: nickel(2+) silicate
OPENEYE Name: nickelous silicate
IUPAC Name: nickel(2+) silicate
SYSTEMATIC NAME: nickel(2+) silicate
MOLECULAR FORMULA: NiO4Si-2
MOLECULAR WEIGHT: 150.7765
SMILES: [O-][Si]([O-])([O-])[O-].[Ni+2]
CAS RN: 28522-15-8
CAS Name: krypton-74
OPENEYE Name: krypton-74
IUPAC Name: krypton-74
SYSTEMATIC NAME: krypton-74
MOLECULAR FORMULA: Kr
MOLECULAR WEIGHT: 73.93326
SMILES: [74Kr]
CAS RN: 14981-57-8
CAS Name: neon-19
OPENEYE Name: neon-19
IUPAC Name: neon-19
SYSTEMATIC NAME: neon-19
MOLECULAR FORMULA: Ne
MOLECULAR WEIGHT: 19.00188
SMILES: [19Ne]
CAS RN: 73292-33-8
CAS Name: 3-hydroxy-12-methyltetradecanoic acid
OPENEYE Name: 3-hydroxy-12-methyl-tetradecanoic acid
IUPAC Name: 3-hydroxy-12-methyltetradecanoic acid
SYSTEMATIC NAME: 12-methyl-3-oxidanyl-tetradecanoic acid
MOLECULAR FORMULA: C15H30O3
MOLECULAR WEIGHT: 258.3969
SMILES: CCC(C)CCCCCCCCC(CC(=O)O)O
CAS RN: 102880-00-2
CAS Name: 1,5,6,10-tetrachlorodecane
OPENEYE Name: 1,5,6,10-tetrachlorodecane
IUPAC Name: 1,5,6,10-tetrachlorodecane
SYSTEMATIC NAME: 1,5,6,10-tetrakis(chloranyl)decane
MOLECULAR FORMULA: C10H18Cl4
MOLECULAR WEIGHT: 280.06192
SMILES: C(CCCl)CC(C(CCCCCl)Cl)Cl
CAS RN: 45227-67-6
CAS Name: iron(3+) hexathiocyanate
OPENEYE Name: ferric hexathiocyanate
IUPAC Name: iron(3+) hexathiocyanate
SYSTEMATIC NAME: iron(3+) hexathiocyanate
MOLECULAR FORMULA: C6FeN6S6-3
MOLECULAR WEIGHT: 404.3394
SMILES: C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[Fe+3]
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