CAS RN: 39260-77-0
CAS Name: 2-hydroxybenzoic acid; lanthanum
OPENEYE Name: 2-hydroxybenzoic acid; lanthanum
IUPAC Name: 2-hydroxybenzoic acid; lanthanum
SYSTEMATIC NAME: lanthanum; 2-oxidanylbenzoic acid
MOLECULAR FORMULA: C21H18LaO9
MOLECULAR WEIGHT: 553.26772
SMILES: C1=CC=C(C(=C1)C(=O)O)O.C1=CC=C(C(=C1)C(=O)O)O.C1=CC=C(C(=C1)C(=O)O)O.[La]
Structure:
CAS RN: 900-92-5
CAS Name: triphenyl-(propan-2-ylamino)phosphonium bromide
OPENEYE Name: (isopropylamino)-triphenyl-phosphonium bromide
IUPAC Name: triphenyl-(propan-2-ylamino)phosphanium bromide
SYSTEMATIC NAME: triphenyl-(propan-2-ylamino)phosphanium bromide
MOLECULAR FORMULA: C21H23BrNP
MOLECULAR WEIGHT: 400.291781
SMILES: CC(C)N[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
Structure:
CAS RN: 33773-14-7
CAS Name: dichloroplatinum; 2-pyrrolidin-1-idecarboxylic acid
OPENEYE Name: dichloroplatinum; pyrrolidin-1-ide-2-carboxylic acid
IUPAC Name: dichloroplatinum; pyrrolidin-1-ide-2-carboxylic acid
SYSTEMATIC NAME: bis(chloranyl)platinum; pyrrolidin-1-ide-2-carboxylic acid
MOLECULAR FORMULA: C5H8Cl2NO2Pt-
MOLECULAR WEIGHT: 380.10652
SMILES: C1CC([N-]C1)C(=O)O.Cl[Pt]Cl
Structure:
CAS RN: 12243-00-4
CAS Name: 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; barium(2+); 2H-quinolin-1-id-8-olate
OPENEYE Name: 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; barium(2+); 2H-quinolin-1-id-8-olate
IUPAC Name: 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; barium(2+); 2H-quinolin-1-id-8-olate
SYSTEMATIC NAME: 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; barium(2+); 2H-quinolin-1-id-8-olate
MOLECULAR FORMULA: C18H22BaN2O2-2
MOLECULAR WEIGHT: 435.70648
SMILES: C1CC2CCC[N-]C2C(C1)[O-].C1C=CC2=C([N-]1)C(=CC=C2)[O-].[Ba+2]
Structure:
CAS RN: 5599-34-8
CAS Name: azido(triphenyl)silane
OPENEYE Name: azido(triphenyl)silane
IUPAC Name: azido(triphenyl)silane
SYSTEMATIC NAME: azido(triphenyl)silane
MOLECULAR FORMULA: C18H15N3Si
MOLECULAR WEIGHT: 301.4173
SMILES: C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)N=[N+]=[N-]
Structure:
CAS RN: 51907-83-6
CAS Name: 9-oxo-2-thioxanthenecarboxylic acid; sodium
OPENEYE Name: 9-oxothioxanthene-2-carboxylic acid; sodium
IUPAC Name: 9-oxothioxanthene-2-carboxylic acid; sodium
SYSTEMATIC NAME: 9-oxidanylidenethioxanthene-2-carboxylic acid; sodium
MOLECULAR FORMULA: C14H8NaO3S
MOLECULAR WEIGHT: 279.26629
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)C(=O)O.[Na]
Structure:
CAS RN: 16201-81-3
CAS Name: 1,2-dimethyl-4-quinazolinone hydrochloride
OPENEYE Name: 1,2-dimethylquinazolin-4-one hydrochloride
IUPAC Name: 1,2-dimethylquinazolin-4-one hydrochloride
SYSTEMATIC NAME: 1,2-dimethylquinazolin-4-one hydrochloride
MOLECULAR FORMULA: C10H11ClN2O
MOLECULAR WEIGHT: 210.66014
SMILES: CC1=NC(=O)C2=CC=CC=C2N1C.Cl
Structure:
CAS RN: 16201-86-8
CAS Name: 1,2,3-trimethyl-4-quinazolin-3-iumone iodide
OPENEYE Name: 1,2,3-trimethylquinazolin-3-ium-4-one iodide
IUPAC Name: 1,2,3-trimethylquinazolin-3-ium-4-one iodide
SYSTEMATIC NAME: 1,2,3-trimethylquinazolin-3-ium-4-one iodide
MOLECULAR FORMULA: C11H13IN2O
MOLECULAR WEIGHT: 316.13819
SMILES: CC1=[N+](C(=O)C2=CC=CC=C2N1C)C.[I-]
Structure:
CAS RN: 60196-98-7
CAS Name: 1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride
OPENEYE Name: 1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride
IUPAC Name: 1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride
SYSTEMATIC NAME: 1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride
MOLECULAR FORMULA: C19H22ClNO4
MOLECULAR WEIGHT: 363.83528
SMILES: COC1=C(C=C(C=C1)C2=NCCC3=CC(=C(C=C32)OC)OC)OC.Cl
Structure:
CAS RN: 30002-12-1
CAS Name: 2,3,11,12-tetramethoxy-6,8,9,13b-tetrahydro-5H-isoquinolino[1,2-a]isoquinoline hydrochloride
OPENEYE Name: 2,3,11,12-tetramethoxy-6,8,9,13b-tetrahydro-5H-isoquinolino[1,2-a]isoquinoline hydrochloride
IUPAC Name: 2,3,11,12-tetramethoxy-6,8,9,13b-tetrahydro-5H-isoquinolino[1,2-a]isoquinoline hydrochloride
SYSTEMATIC NAME: 2,3,11,12-tetramethoxy-6,8,9,13b-tetrahydro-5H-isoquinolino[1,2-a]isoquinoline hydrochloride
MOLECULAR FORMULA: C21H26ClNO4
MOLECULAR WEIGHT: 391.88844
SMILES: COC1=C(C=C2C3C4=CC(=C(C=C4CCN3CCC2=C1)OC)OC)OC.Cl
Structure:
CAS RN: 67913-95-5
CAS Name: phenyl-(2-pyridinylamino)methanesulfonic acid; sodium
OPENEYE Name: phenyl-(2-pyridylamino)methanesulfonic acid; sodium
IUPAC Name: phenyl-(pyridin-2-ylamino)methanesulfonic acid; sodium
SYSTEMATIC NAME: phenyl-(pyridin-2-ylamino)methanesulfonic acid; sodium
MOLECULAR FORMULA: C12H12N2NaO3S
MOLECULAR WEIGHT: 287.29005
SMILES: C1=CC=C(C=C1)C(NC2=CC=CC=N2)S(=O)(=O)O.[Na]
Structure:
CAS RN: 76127-13-4
CAS Name: 1-(3-chloroanilino)ethanesulfonic acid; sodium
OPENEYE Name: 1-(3-chloroanilino)ethanesulfonic acid; sodium
IUPAC Name: 1-(3-chloroanilino)ethanesulfonic acid; sodium
SYSTEMATIC NAME: 1-[(3-chlorophenyl)amino]ethanesulfonic acid; sodium
MOLECULAR FORMULA: C8H10ClNNaO3S
MOLECULAR WEIGHT: 258.67767
SMILES: CC(NC1=CC(=CC=C1)Cl)S(=O)(=O)O.[Na]
Structure:
CAS RN: 60399-28-2
CAS Name: dichloroplatinum(2+); [2-[(1-ethoxy-3-hydroxy-1-oxopropan-2-yl)amino]-2-oxoethyl]azanide
OPENEYE Name: dichloroplatinum(2+); [2-[[2-ethoxy-1-(hydroxymethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]azanide
IUPAC Name: dichloroplatinum(2+); [2-[(1-ethoxy-3-hydroxy-1-oxopropan-2-yl)amino]-2-oxoethyl]azanide
SYSTEMATIC NAME: bis(chloranyl)platinum(2+); [2-[(1-ethoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-2-oxidanylidene-ethyl]azanide
MOLECULAR FORMULA: C14H26Cl2N4O8Pt
MOLECULAR WEIGHT: 644.36224
SMILES: CCOC(=O)C(CO)NC(=O)C[NH-].CCOC(=O)C(CO)NC(=O)C[NH-].Cl[Pt+2]Cl
Structure:
CAS RN: 50627-27-5
CAS Name: 8-hydroxy-2-imino-6-(2-methylpropyl)-4-pteridinamine
OPENEYE Name: 8-hydroxy-2-imino-6-isobutyl-pteridin-4-amine
IUPAC Name: 8-hydroxy-2-imino-6-(2-methylpropyl)pteridin-4-amine
SYSTEMATIC NAME: 2-azanylidene-6-(2-methylpropyl)-8-oxidanyl-pteridin-4-amine
MOLECULAR FORMULA: C10H14N6O
MOLECULAR WEIGHT: 234.25776
SMILES: CC(C)CC1=CN(C2=NC(=N)N=C(C2=N1)N)O
Structure:
CAS RN: 50627-28-6
CAS Name: 8-hydroxy-2-imino-6-pentyl-4-pteridinamine
OPENEYE Name: 8-hydroxy-2-imino-6-pentyl-pteridin-4-amine
IUPAC Name: 8-hydroxy-2-imino-6-pentylpteridin-4-amine
SYSTEMATIC NAME: 2-azanylidene-8-oxidanyl-6-pentyl-pteridin-4-amine
MOLECULAR FORMULA: C11H16N6O
MOLECULAR WEIGHT: 248.28434
SMILES: CCCCCC1=CN(C2=NC(=N)N=C(C2=N1)N)O
Structure:
CAS RN: 20210-03-1
CAS Name: 2-amino-8-hydroxy-6-methyl-4-pteridinone
OPENEYE Name: 2-amino-8-hydroxy-6-methyl-pteridin-4-one
IUPAC Name: 2-amino-8-hydroxy-6-methylpteridin-4-one
SYSTEMATIC NAME: 2-azanyl-6-methyl-8-oxidanyl-pteridin-4-one
MOLECULAR FORMULA: C7H7N5O2
MOLECULAR WEIGHT: 193.16278
SMILES: CC1=CN(C2=NC(=NC(=O)C2=N1)N)O
Structure:
CAS RN: 28519-50-8
CAS Name: hydroxy-(4-methylphenyl)-oxo-sulfanylidene-$l^{6}-sulfane; potassium
OPENEYE Name: hydroxy-oxo-(p-tolyl)-thioxo-$l^{6}-sulfane; potassium
IUPAC Name: hydroxy-(4-methylphenyl)-oxo-sulfanylidene-$l^{6}-sulfane; potassium
SYSTEMATIC NAME: (4-methylphenyl)-oxidanyl-oxidanylidene-sulfanylidene-$l^{6}-sulfane; potassium
MOLECULAR FORMULA: C7H8KO2S2
MOLECULAR WEIGHT: 227.36552
SMILES: CC1=CC=C(C=C1)S(=O)(=S)O.[K]
Structure:
CAS RN: 63797-62-6
CAS Name: 1-cyclohex-3-enyl(triphenyl)phosphonium bromide
OPENEYE Name: cyclohex-3-en-1-yl(triphenyl)phosphonium bromide
IUPAC Name: cyclohex-3-en-1-yl(triphenyl)phosphanium bromide
SYSTEMATIC NAME: cyclohex-3-en-1-yl(triphenyl)phosphanium bromide
MOLECULAR FORMULA: C24H24BrP
MOLECULAR WEIGHT: 423.325121
SMILES: C1CC(CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Structure:
CAS RN: 54222-64-9
CAS Name: (3,4-dimethyl-1-cyclohex-3-enyl)-triphenylphosphonium bromide
OPENEYE Name: (3,4-dimethylcyclohex-3-en-1-yl)-triphenyl-phosphonium bromide
IUPAC Name: (3,4-dimethylcyclohex-3-en-1-yl)-triphenylphosphanium bromide
SYSTEMATIC NAME: (3,4-dimethylcyclohex-3-en-1-yl)-triphenyl-phosphanium bromide
MOLECULAR FORMULA: C26H28BrP
MOLECULAR WEIGHT: 451.378281
SMILES: CC1=C(CC(CC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]
Structure:
CAS RN: 14302-17-1
CAS Name: azanide; cobalt; trithiocyanate
OPENEYE Name: azanide; cobalt; trithiocyanate
IUPAC Name: azanide; cobalt; trithiocyanate
SYSTEMATIC NAME: azanide; cobalt; trithiocyanate
MOLECULAR FORMULA: C3H6CoN6S3-6
MOLECULAR WEIGHT: 281.24814
SMILES: C(#N)[S-].C(#N)[S-].C(#N)[S-].[NH2-].[NH2-].[NH2-].[Co]
Structure:
CAS RN: 20169-56-6
CAS Name: 6-(phenylmethylthio)-2,3,4,5-tetrahydropyridine hydrochloride
OPENEYE Name: 6-benzylsulfanyl-2,3,4,5-tetrahydropyridine hydrochloride
IUPAC Name: 6-benzylsulfanyl-2,3,4,5-tetrahydropyridine hydrochloride
SYSTEMATIC NAME: 6-(phenylmethylsulfanyl)-2,3,4,5-tetrahydropyridine hydrochloride
MOLECULAR FORMULA: C12H16ClNS
MOLECULAR WEIGHT: 241.78014
SMILES: C1CCN=C(C1)SCC2=CC=CC=C2.Cl
Structure:
CAS RN: 15005-14-8
CAS Name: 2-azanidylethylazanide; dibromocobalt
OPENEYE Name: 2-azanidylethylazanide; dibromocobalt
IUPAC Name: 2-azanidylethylazanide; dibromocobalt
SYSTEMATIC NAME: 2-azanidylethylazanide; bis(bromanyl)cobalt
MOLECULAR FORMULA: C4H12Br2CoN4-4
MOLECULAR WEIGHT: 334.90608
SMILES: C(C[NH-])[NH-].C(C[NH-])[NH-].[Co](Br)Br
Structure:
CAS RN: 20833-18-5
CAS Name: azanide; cobalt; cyanide
OPENEYE Name: azanide; cobalt; cyanide
IUPAC Name: azanide; cobalt; cyanide
SYSTEMATIC NAME: azanide; cobalt; cyanide
MOLECULAR FORMULA: CH10CoN6-6
MOLECULAR WEIGHT: 165.0635
SMILES: [C-]#N.[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[Co]
Structure:
CAS RN: 15613-11-3
CAS Name: cobalt; piperidin-1-ide; 2H-pyridin-1-ide; dithiocyanate
OPENEYE Name: cobalt; piperidin-1-ide; 2H-pyridin-1-ide; dithiocyanate
IUPAC Name: cobalt; piperidin-1-ide; 2H-pyridin-1-ide; dithiocyanate
SYSTEMATIC NAME: cobalt; piperidin-1-ide; 2H-pyridin-1-ide; dithiocyanate
MOLECULAR FORMULA: C12H16CoN4S2-4
MOLECULAR WEIGHT: 339.34544
SMILES: C1CC[N-]CC1.C1C=CC=C[N-]1.C(#N)[S-].C(#N)[S-].[Co]
Structure:
CAS RN: 15731-41-6
CAS Name: copper; 5-chloro-7-iodo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-ol; 5-chloro-7-iodo-1,2-dihydroquinolin-8-olate
OPENEYE Name: copper; 5-chloro-7-iodo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-ol; 5-chloro-7-iodo-1,2-dihydroquinolin-8-olate
IUPAC Name: copper; 5-chloro-7-iodo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-ol; 5-chloro-7-iodo-1,2-dihydroquinolin-8-olate
SYSTEMATIC NAME: copper; 5-chloranyl-7-iodanyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-ol; 5-chloranyl-7-iodanyl-1,2-dihydroquinolin-8-olate
MOLECULAR FORMULA: C18H20Cl2CuI2N2O2
MOLECULAR WEIGHT: 684.62454
SMILES: C1CC2C(CC(C(C2[N-]C1)O)I)Cl.C1C=CC2=C(N1)C(=C(C=C2Cl)I)[O-].[Cu+2]
Structure:
CAS RN: 14655-06-2
CAS Name: copper; (6Z)-6-[[(phenylmethyl)amino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-[(benzylamino)methylene]cyclohexa-2,4-dien-1-one; copper
IUPAC Name: (6Z)-6-[(benzylamino)methylidene]cyclohexa-2,4-dien-1-one; copper
SYSTEMATIC NAME: copper; (6Z)-6-[[(phenylmethyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C28H26CuN2O2
MOLECULAR WEIGHT: 486.06424
SMILES: C1=CC=C(C=C1)CN/C=C/2\C(=O)C=CC=C2.C1=CC=C(C=C1)CN/C=C/2\C(=O)C=CC=C2.[Cu]
Structure:
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