CAS RN: 6893-32-9
CAS Name: 2-[2-(1-methyl-1-piperidin-1-iumyl)ethyl]pyridine iodide
OPENEYE Name: 2-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]pyridine iodide
IUPAC Name: 2-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]pyridine iodide
SYSTEMATIC NAME: 2-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]pyridine iodide
MOLECULAR FORMULA: C13H21IN2
MOLECULAR WEIGHT: 332.22371
SMILES: C[N+]1(CCCCC1)CCC2=CC=CC=N2.[I-]
Structure:
CAS RN: 6892-97-3
CAS Name: 4-(4-phenyl-1-piperazinyl)-3-pyridinamine
OPENEYE Name: 4-(4-phenylpiperazin-1-yl)pyridin-3-amine
IUPAC Name: 4-(4-phenylpiperazin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 4-(4-phenylpiperazin-1-yl)pyridin-3-amine
MOLECULAR FORMULA: C15H18N4
MOLECULAR WEIGHT: 254.33022
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=C(C=NC=C3)N
Structure:
CAS RN: 6884-59-9
CAS Name: N-methylcarbamic acid [2-(dimethoxymethyl)phenyl] ester
OPENEYE Name: [2-(dimethoxymethyl)phenyl] N-methylcarbamate
IUPAC Name: [2-(dimethoxymethyl)phenyl] N-methylcarbamate
SYSTEMATIC NAME: [2-(dimethoxymethyl)phenyl] N-methylcarbamate
MOLECULAR FORMULA: C11H15NO4
MOLECULAR WEIGHT: 225.2411
SMILES: CNC(=O)OC1=CC=CC=C1C(OC)OC
Structure:
CAS RN: 6879-28-3
CAS Name: acetic acid [(4R,5R,10R,13S,17S)-3-[benzoyl(methyl)amino]-17-[1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] ester
OPENEYE Name: [(4R,5R,10R,13S,17S)-3-[benzoyl(methyl)amino]-17-[1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] acetate
IUPAC Name: [(4R,5R,10R,13S,17S)-3-[benzoyl(methyl)amino]-17-[1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] acetate
SYSTEMATIC NAME: [(4R,5R,10R,13S,17S)-17-[1-(dimethylamino)ethyl]-10,13-dimethyl-3-[methyl(phenylcarbonyl)amino]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] ethanoate
MOLECULAR FORMULA: C33H50N2O3
MOLECULAR WEIGHT: 522.7617
SMILES: CC([C@H]1CCC2[C@@]1(CCC3C2CC[C@@H]4[C@@]3(CCC([C@@H]4OC(=O)C)N(C)C(=O)C5=CC=CC=C5)C)C)N(C)C
Structure:
CAS RN: 6878-18-8
CAS Name: 2-[(10R)-2-(hydroxymethyl)-10-methoxy-4,6,10,11-tetrahydro-3H-pyrido[2,1-i]indol-1-yl]ethanol
OPENEYE Name: 2-[(10R)-2-(hydroxymethyl)-10-methoxy-4,6,10,11-tetrahydro-3H-pyrido[2,1-i]indol-1-yl]ethanol
IUPAC Name: 2-[(10R)-2-(hydroxymethyl)-10-methoxy-4,6,10,11-tetrahydro-3H-pyrido[2,1-i]indol-1-yl]ethanol
SYSTEMATIC NAME: 2-[(10R)-2-(hydroxymethyl)-10-methoxy-4,6,10,11-tetrahydro-3H-pyrido[2,1-i]indol-1-yl]ethanol
MOLECULAR FORMULA: C16H23NO3
MOLECULAR WEIGHT: 277.35872
SMILES: CO[C@@H]1CC23C(=CCN2CCC(=C3CCO)CO)C=C1
Structure:
CAS RN: 6869-17-6
CAS Name: (3S,5S,8R,9S,10S,13R,17S)-3-[[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyl-2-oxanyl]oxy]-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxaldehyde
OPENEYE Name: (3S,5S,8R,9S,10S,13R,17S)-3-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
IUPAC Name: (3S,5S,8R,9S,10S,13R,17S)-3-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
SYSTEMATIC NAME: (3S,5S,8R,9S,10S,13R,17S)-13-methyl-3-[(2S,4S,5S,6R)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-5,14-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
MOLECULAR FORMULA: C29H42O9
MOLECULAR WEIGHT: 534.63838
SMILES: C[C@@H]1[C@H]([C@H](C[C@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@@H](CCC5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O
Structure:
CAS RN: 6866-93-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H23N2O+
MOLECULAR WEIGHT: 307.40942
SMILES: CC=C1C[N+]2(CCC34[C@@H]2C[C@@H]1C(=C3NC5=CC=CC=C45)C=O)C
Structure:
CAS RN: 6860-63-5
CAS Name: 4-[4-(diethylamino)phenyl]-N,N-diethylaniline
OPENEYE Name: 4-[4-(diethylamino)phenyl]-N,N-diethyl-aniline
IUPAC Name: 4-[4-(diethylamino)phenyl]-N,N-diethylaniline
SYSTEMATIC NAME: 4-[4-(diethylamino)phenyl]-N,N-diethyl-aniline
MOLECULAR FORMULA: C20H28N2
MOLECULAR WEIGHT: 296.44972
SMILES: CCN(CC)C1=CC=C(C=C1)C2=CC=C(C=C2)N(CC)CC
Structure:
CAS RN: 6860-60-2
CAS Name: N'-acetyl-2-[[2-(acetylhydrazo)-2-oxoethyl]disulfanyl]acetohydrazide
OPENEYE Name: N'-acetyl-2-[[2-(2-acetylhydrazino)-2-oxo-ethyl]disulfanyl]acetohydrazide
IUPAC Name: N'-acetyl-2-[[2-(2-acetylhydrazinyl)-2-oxoethyl]disulfanyl]acetohydrazide
SYSTEMATIC NAME: N'-ethanoyl-2-[[2-(2-ethanoylhydrazinyl)-2-oxidanylidene-ethyl]disulfanyl]ethanehydrazide
MOLECULAR FORMULA: C8H14N4O4S2
MOLECULAR WEIGHT: 294.35116
SMILES: CC(=O)NNC(=O)CSSCC(=O)NNC(=O)C
Structure:
CAS RN: 6856-43-5
CAS Name: 1-cyclohexyl-3-(1-methyl-1-piperidin-1-iumyl)-1-phenyl-1-propanol iodide
OPENEYE Name: 1-cyclohexyl-3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-ol iodide
IUPAC Name: 1-cyclohexyl-3-(1-methylpiperidin-1-ium-1-yl)-1-phenylpropan-1-ol iodide
SYSTEMATIC NAME: 1-cyclohexyl-3-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-ol iodide
MOLECULAR FORMULA: C21H34INO
MOLECULAR WEIGHT: 443.40523
SMILES: C[N+]1(CCCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.[I-]
Structure:
CAS RN: 6856-40-2
CAS Name: 1-cyclohexyl-3-(1-methyl-1-pyrrolidin-1-iumyl)-1-phenyl-1-propanol iodide
OPENEYE Name: 1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenyl-propan-1-ol iodide
IUPAC Name: 1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenylpropan-1-ol iodide
SYSTEMATIC NAME: 1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenyl-propan-1-ol iodide
MOLECULAR FORMULA: C20H32INO
MOLECULAR WEIGHT: 429.37865
SMILES: C[N+]1(CCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.[I-]
Structure:
CAS RN: 6856-18-4
CAS Name: 2,4-dichloro-1-[ethoxy-(methylthio)phosphoryl]oxybenzene
OPENEYE Name: 2,4-dichloro-1-[ethoxy(methylsulfanyl)phosphoryl]oxy-benzene
IUPAC Name: 2,4-dichloro-1-[ethoxy(methylsulfanyl)phosphoryl]oxybenzene
SYSTEMATIC NAME: 2,4-bis(chloranyl)-1-[ethoxy(methylsulfanyl)phosphoryl]oxy-benzene
MOLECULAR FORMULA: C9H11Cl2O3PS
MOLECULAR WEIGHT: 301.126601
SMILES: CCOP(=O)(OC1=C(C=C(C=C1)Cl)Cl)SC
Structure:
CAS RN: 6854-34-8
CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(4-hydroxyphenyl)methanone
OPENEYE Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-hydroxyphenyl)methanone
IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-hydroxyphenyl)methanone
SYSTEMATIC NAME: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-hydroxyphenyl)methanone
MOLECULAR FORMULA: C19H20N2O4
MOLECULAR WEIGHT: 340.3731
SMILES: C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)O
Structure:
CAS RN: 6854-33-7
CAS Name: 1,3-benzodioxol-5-yl-[4-[1-(1,3-benzodioxol-5-yl)ethyl]-1-piperazinyl]methanone hydrochloride
OPENEYE Name: 1,3-benzodioxol-5-yl-[4-[1-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]methanone hydrochloride
IUPAC Name: 1,3-benzodioxol-5-yl-[4-[1-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]methanone hydrochloride
SYSTEMATIC NAME: 1,3-benzodioxol-5-yl-[4-[1-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]methanone hydrochloride
MOLECULAR FORMULA: C21H23ClN2O5
MOLECULAR WEIGHT: 418.87072
SMILES: CC(C1=CC2=C(C=C1)OCO2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5.Cl
Structure:
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