CAS RN: 7714-93-4
CAS Name: 2-(methylthio)-1-phenylethanol
OPENEYE Name: 2-methylsulfanyl-1-phenyl-ethanol
IUPAC Name: 2-methylsulfanyl-1-phenylethanol
SYSTEMATIC NAME: 2-methylsulfanyl-1-phenyl-ethanol
MOLECULAR FORMULA: C9H12OS
MOLECULAR WEIGHT: 168.25598
SMILES: CSCC(C1=CC=CC=C1)O
Structure:
CAS RN: 7683-07-0
CAS Name: 1,2,3,4,6,7,8,9-octachlorothianthrene
OPENEYE Name: 1,2,3,4,6,7,8,9-octachlorothianthrene
IUPAC Name: 1,2,3,4,6,7,8,9-octachlorothianthrene
SYSTEMATIC NAME: 1,2,3,4,6,7,8,9-octakis(chloranyl)thianthrene
MOLECULAR FORMULA: C12Cl8S2
MOLECULAR WEIGHT: 491.8824
SMILES: C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)SC3=C(S2)C(=C(C(=C3Cl)Cl)Cl)Cl
Structure:
CAS RN: 7678-64-0
CAS Name: 10-[3-(dimethylamino)propyl]-2-phenothiazinecarbonitrile
OPENEYE Name: 10-[3-(dimethylamino)propyl]phenothiazine-2-carbonitrile
IUPAC Name: 10-[3-(dimethylamino)propyl]phenothiazine-2-carbonitrile
SYSTEMATIC NAME: 10-[3-(dimethylamino)propyl]phenothiazine-2-carbonitrile
MOLECULAR FORMULA: C18H19N3S
MOLECULAR WEIGHT: 309.42856
SMILES: CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C#N
Structure:
CAS RN: 7647-13-4
CAS Name: ammonium 2-propene-1-sulfonate
OPENEYE Name: ammonium prop-2-ene-1-sulfonate
IUPAC Name: azanium prop-2-ene-1-sulfonate
SYSTEMATIC NAME: azanium prop-2-ene-1-sulfonate
MOLECULAR FORMULA: C3H9NO3S
MOLECULAR WEIGHT: 139.17346
SMILES: C=CCS(=O)(=O)[O-].[NH4+]
Structure:
CAS RN: 7615-76-1
CAS Name: [[2-bis(phenylthio)phosphorylethyl-(phenylthio)phosphoryl]thio]benzene
OPENEYE Name: [2-bis(phenylsulfanyl)phosphorylethyl-phenylsulfanyl-phosphoryl]sulfanylbenzene
IUPAC Name: [2-bis(phenylsulfanyl)phosphorylethyl-phenylsulfanylphosphoryl]sulfanylbenzene
SYSTEMATIC NAME: [2-bis(phenylsulfanyl)phosphorylethyl-phenylsulfanyl-phosphoryl]sulfanylbenzene
MOLECULAR FORMULA: C26H24O2P2S4
MOLECULAR WEIGHT: 558.675082
SMILES: C1=CC=C(C=C1)SP(=O)(CCP(=O)(SC2=CC=CC=C2)SC3=CC=CC=C3)SC4=CC=CC=C4
Structure:
CAS RN: 7583-60-0
CAS Name: 2-(1-piperidinyl)-1-cyclohexanone hydrochloride
OPENEYE Name: 2-(1-piperidyl)cyclohexanone hydrochloride
IUPAC Name: 2-piperidin-1-ylcyclohexan-1-one hydrochloride
SYSTEMATIC NAME: 2-piperidin-1-ylcyclohexan-1-one hydrochloride
MOLECULAR FORMULA: C11H20ClNO
MOLECULAR WEIGHT: 217.7356
SMILES: C1CCN(CC1)C2CCCCC2=O.Cl
Structure:
CAS RN: 71510-64-0
CAS Name: 4-[(phenylmethyl)amino]butanenitrile
OPENEYE Name: 4-(benzylamino)butanenitrile
IUPAC Name: 4-(benzylamino)butanenitrile
SYSTEMATIC NAME: 4-[(phenylmethyl)amino]butanenitrile
MOLECULAR FORMULA: C11H14N2
MOLECULAR WEIGHT: 174.24226
SMILES: C1=CC=C(C=C1)CNCCCC#N
Structure:
CAS RN: 7544-97-0
CAS Name: 4-[(phenylmethyl)amino]butanenitrile hydrochloride
OPENEYE Name: 4-(benzylamino)butanenitrile hydrochloride
IUPAC Name: 4-(benzylamino)butanenitrile hydrochloride
SYSTEMATIC NAME: 4-[(phenylmethyl)amino]butanenitrile hydrochloride
MOLECULAR FORMULA: C11H15ClN2
MOLECULAR WEIGHT: 210.7032
SMILES: C1=CC=C(C=C1)CNCCCC#N.Cl
Structure:
CAS RN: 7416-57-1
CAS Name: 10-methyldodecanoic acid
OPENEYE Name: 10-methyldodecanoic acid
IUPAC Name: 10-methyldodecanoic acid
SYSTEMATIC NAME: 10-methyldodecanoic acid
MOLECULAR FORMULA: C13H26O2
MOLECULAR WEIGHT: 214.34434
SMILES: CCC(C)CCCCCCCCC(=O)O
Structure:
CAS RN: 7407-74-1
CAS Name: 4-(2,4-dichlorophenoxy)-3-hydroxybutanoic acid
OPENEYE Name: 4-(2,4-dichlorophenoxy)-3-hydroxy-butanoic acid
IUPAC Name: 4-(2,4-dichlorophenoxy)-3-hydroxybutanoic acid
SYSTEMATIC NAME: 4-[2,4-bis(chloranyl)phenoxy]-3-oxidanyl-butanoic acid
MOLECULAR FORMULA: C10H10Cl2O4
MOLECULAR WEIGHT: 265.09
SMILES: C1=CC(=C(C=C1Cl)Cl)OCC(CC(=O)O)O
Structure:
CAS RN: 7397-93-5
CAS Name: 6-bromochrysene
OPENEYE Name: 6-bromochrysene
IUPAC Name: 6-bromochrysene
SYSTEMATIC NAME: 6-bromanylchrysene
MOLECULAR FORMULA: C18H11Br
MOLECULAR WEIGHT: 307.18394
SMILES: C1=CC=C2C(=C1)C=CC3=C2C=C(C4=CC=CC=C34)Br
Structure:
CAS RN: 7383-87-1
CAS Name: 1,3-dimethyl-5-(4-methylphenyl)benzene
OPENEYE Name: 1,3-dimethyl-5-(p-tolyl)benzene
IUPAC Name: 1,3-dimethyl-5-(4-methylphenyl)benzene
SYSTEMATIC NAME: 1,3-dimethyl-5-(4-methylphenyl)benzene
MOLECULAR FORMULA: C15H16
MOLECULAR WEIGHT: 196.28754
SMILES: CC1=CC=C(C=C1)C2=CC(=CC(=C2)C)C
Structure:
CAS RN: 7362-34-7
CAS Name: trimethylselenonium iodide
OPENEYE Name: trimethylselenonium iodide
IUPAC Name: trimethylselanium iodide
SYSTEMATIC NAME: trimethylselanium iodide
MOLECULAR FORMULA: C3H9ISe
MOLECULAR WEIGHT: 250.96803
SMILES: C[Se+](C)C.[I-]
Structure:
CAS RN: 7361-30-0
CAS Name: 2-[[(6-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid
OPENEYE Name: 2-[(6-chloropyridine-2-carbonyl)amino]acetic acid
IUPAC Name: 2-[(6-chloropyridine-2-carbonyl)amino]acetic acid
SYSTEMATIC NAME: 2-[(6-chloranylpyridin-2-yl)carbonylamino]ethanoic acid
MOLECULAR FORMULA: C8H7ClN2O3
MOLECULAR WEIGHT: 214.60578
SMILES: C1=CC(=NC(=C1)Cl)C(=O)NCC(=O)O
Structure:
CAS RN: 7298-86-4
CAS Name: 2,2-dichloro-5,5-dimethylcyclohexane-1,3-dione
OPENEYE Name: 2,2-dichloro-5,5-dimethyl-cyclohexane-1,3-dione
IUPAC Name: 2,2-dichloro-5,5-dimethylcyclohexane-1,3-dione
SYSTEMATIC NAME: 2,2-bis(chloranyl)-5,5-dimethyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C8H10Cl2O2
MOLECULAR WEIGHT: 209.0698
SMILES: CC1(CC(=O)C(C(=O)C1)(Cl)Cl)C
Structure:
CAS RN: 7290-25-7
CAS Name: 4-(bromomethyl)-2-[4-(bromomethyl)phenoxy]-1-methoxybenzene
OPENEYE Name: 4-(bromomethyl)-2-[4-(bromomethyl)phenoxy]-1-methoxy-benzene
IUPAC Name: 4-(bromomethyl)-2-[4-(bromomethyl)phenoxy]-1-methoxybenzene
SYSTEMATIC NAME: 4-(bromomethyl)-2-[4-(bromomethyl)phenoxy]-1-methoxy-benzene
MOLECULAR FORMULA: C15H14Br2O2
MOLECULAR WEIGHT: 386.07846
SMILES: COC1=C(C=C(C=C1)CBr)OC2=CC=C(C=C2)CBr
Structure:
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