CAS RN: 14692-49-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24ClN
MOLECULAR WEIGHT: 313.86426
SMILES: CN(C)CCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24.Cl
Structure:
CAS RN: 14692-47-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H25N
MOLECULAR WEIGHT: 303.4406
SMILES: C1CCN(CC1)CC2CC3C4=CC=CC=C4C2C5=CC=CC=C35
Structure:
CAS RN: 14692-45-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H25N
MOLECULAR WEIGHT: 291.4299
SMILES: CCN(CC)CC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
Structure:
CAS RN: 14690-00-7
CAS Name: 2-phenylmethoxypropane-1,3-diol
OPENEYE Name: 2-benzyloxypropane-1,3-diol
IUPAC Name: 2-phenylmethoxypropane-1,3-diol
SYSTEMATIC NAME: 2-phenylmethoxypropane-1,3-diol
MOLECULAR FORMULA: C10H14O3
MOLECULAR WEIGHT: 182.21636
SMILES: C1=CC=C(C=C1)COC(CO)CO
Structure:
CAS RN: 14683-91-1
CAS Name: 2-heptyl-5-propoxyphenol
OPENEYE Name: 2-heptyl-5-propoxy-phenol
IUPAC Name: 2-heptyl-5-propoxyphenol
SYSTEMATIC NAME: 2-heptyl-5-propoxy-phenol
MOLECULAR FORMULA: C16H26O2
MOLECULAR WEIGHT: 250.37644
SMILES: CCCCCCCC1=C(C=C(C=C1)OCCC)O
Structure:
CAS RN: 14673-04-2
CAS Name: 4-(1-aziridinyl)-6-chloropyrimidine
OPENEYE Name: 4-(aziridin-1-yl)-6-chloro-pyrimidine
IUPAC Name: 4-(aziridin-1-yl)-6-chloropyrimidine
SYSTEMATIC NAME: 4-(aziridin-1-yl)-6-chloranyl-pyrimidine
MOLECULAR FORMULA: C6H6ClN3
MOLECULAR WEIGHT: 155.58494
SMILES: C1CN1C2=CC(=NC=N2)Cl
Structure:
CAS RN: 14669-28-4
CAS Name: 1-[2-[2-(phenylmethyl)-3H-inden-1-yl]ethyl]piperidine hydrochloride
OPENEYE Name: 1-[2-(2-benzyl-3H-inden-1-yl)ethyl]piperidine hydrochloride
IUPAC Name: 1-[2-(2-benzyl-3H-inden-1-yl)ethyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[2-[2-(phenylmethyl)-3H-inden-1-yl]ethyl]piperidine hydrochloride
MOLECULAR FORMULA: C23H28ClN
MOLECULAR WEIGHT: 353.92812
SMILES: C1CCN(CC1)CCC2=C(CC3=CC=CC=C32)CC4=CC=CC=C4.Cl
Structure:
CAS RN: 14669-27-3
CAS Name: oxalic acid; 1-[2-[[(1S,2R)-2-(phenylmethyl)-2,3-dihydro-1H-inden-1-yl]oxy]ethyl]piperidine
OPENEYE Name: 1-[2-[(1S,2R)-2-benzylindan-1-yl]oxyethyl]piperidine; oxalic acid
IUPAC Name: 1-[2-[[(1S,2R)-2-benzyl-2,3-dihydro-1H-inden-1-yl]oxy]ethyl]piperidine; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; 1-[2-[[(1S,2R)-2-(phenylmethyl)-2,3-dihydro-1H-inden-1-yl]oxy]ethyl]piperidine
MOLECULAR FORMULA: C25H31NO5
MOLECULAR WEIGHT: 425.51734
SMILES: C1CCN(CC1)CCO[C@H]2[C@@H](CC3=CC=CC=C23)CC4=CC=CC=C4.C(=O)(C(=O)O)O
Structure:
CAS RN: 14669-26-2
CAS Name: N,N-dimethyl-3-[2-(phenylmethyl)-3H-inden-1-yl]-1-propanamine hydrochloride
OPENEYE Name: 3-(2-benzyl-3H-inden-1-yl)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: 3-(2-benzyl-3H-inden-1-yl)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-3-[2-(phenylmethyl)-3H-inden-1-yl]propan-1-amine hydrochloride
MOLECULAR FORMULA: C21H26ClN
MOLECULAR WEIGHT: 327.89084
SMILES: CN(C)CCCC1=C(CC2=CC=CC=C21)CC3=CC=CC=C3.Cl
Structure:
CAS RN: 14669-24-0
CAS Name: 1-[2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]ethyl]piperidine hydrochloride
OPENEYE Name: 1-[2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]ethyl]piperidine hydrochloride
IUPAC Name: 1-[2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]ethyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]ethyl]piperidine hydrochloride
MOLECULAR FORMULA: C23H27ClFN
MOLECULAR WEIGHT: 371.918583
SMILES: C1CCN(CC1)CCC2=C(CC3=CC=CC=C32)CC4=CC=C(C=C4)F.Cl
Structure:
CAS RN: 14669-23-9
CAS Name: 2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]-N,N-dimethylethanamine hydrochloride
OPENEYE Name: 2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]-N,N-dimethyl-ethanamine hydrochloride
IUPAC Name: 2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]-N,N-dimethylethanamine hydrochloride
SYSTEMATIC NAME: 2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]-N,N-dimethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C20H23ClFN
MOLECULAR WEIGHT: 331.854723
SMILES: CN(C)CCC1=C(CC2=CC=CC=C21)CC3=CC=C(C=C3)F.Cl
Structure:
CAS RN: 14669-21-7
CAS Name: 1-[2-[2-(phenylmethyl)-3H-inden-1-yl]ethyl]pyrrolidine hydrochloride
OPENEYE Name: 1-[2-(2-benzyl-3H-inden-1-yl)ethyl]pyrrolidine hydrochloride
IUPAC Name: 1-[2-(2-benzyl-3H-inden-1-yl)ethyl]pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-[2-[2-(phenylmethyl)-3H-inden-1-yl]ethyl]pyrrolidine hydrochloride
MOLECULAR FORMULA: C22H26ClN
MOLECULAR WEIGHT: 339.90154
SMILES: C1CCN(C1)CCC2=C(CC3=CC=CC=C32)CC4=CC=CC=C4.Cl
Structure:
CAS RN: 14669-20-6
CAS Name: N,N-diethyl-2-[2-(phenylmethyl)-3H-inden-1-yl]ethanamine hydrochloride
OPENEYE Name: 2-(2-benzyl-3H-inden-1-yl)-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: 2-(2-benzyl-3H-inden-1-yl)-N,N-diethylethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethyl-2-[2-(phenylmethyl)-3H-inden-1-yl]ethanamine hydrochloride
MOLECULAR FORMULA: C22H28ClN
MOLECULAR WEIGHT: 341.91742
SMILES: CCN(CC)CCC1=C(CC2=CC=CC=C21)CC3=CC=CC=C3.Cl
Structure:
CAS RN: 14669-17-1
CAS Name: carbamic acid (1-hexoxy-3-prop-2-ynoxypropan-2-yl) ester
OPENEYE Name: [1-(hexoxymethyl)-2-prop-2-ynoxy-ethyl] carbamate
IUPAC Name: (1-hexoxy-3-prop-2-ynoxypropan-2-yl) carbamate
SYSTEMATIC NAME: (1-hexoxy-3-prop-2-ynoxy-propan-2-yl) carbamate
MOLECULAR FORMULA: C13H23NO4
MOLECULAR WEIGHT: 257.32602
SMILES: CCCCCCOCC(COCC#C)OC(=O)N
Structure:
CAS RN: 14669-16-0
CAS Name: carbamic acid [1-(3-methylbutoxy)-3-prop-2-ynoxypropan-2-yl] ester
OPENEYE Name: [1-(isopentyloxymethyl)-2-prop-2-ynoxy-ethyl] carbamate
IUPAC Name: [1-(3-methylbutoxy)-3-prop-2-ynoxypropan-2-yl] carbamate
SYSTEMATIC NAME: [1-(3-methylbutoxy)-3-prop-2-ynoxy-propan-2-yl] carbamate
MOLECULAR FORMULA: C12H21NO4
MOLECULAR WEIGHT: 243.29944
SMILES: CC(C)CCOCC(COCC#C)OC(=O)N
Structure:
CAS RN: 14669-15-9
CAS Name: carbamic acid (1-phenylmethoxy-3-prop-2-ynoxypropan-2-yl) ester
OPENEYE Name: [1-(benzyloxymethyl)-2-prop-2-ynoxy-ethyl] carbamate
IUPAC Name: (1-phenylmethoxy-3-prop-2-ynoxypropan-2-yl) carbamate
SYSTEMATIC NAME: (1-phenylmethoxy-3-prop-2-ynoxy-propan-2-yl) carbamate
MOLECULAR FORMULA: C14H17NO4
MOLECULAR WEIGHT: 263.28908
SMILES: C#CCOCC(COCC1=CC=CC=C1)OC(=O)N
Structure:
CAS RN: 14669-14-8
CAS Name: carbamic acid (1-pentoxy-3-prop-2-ynoxypropan-2-yl) ester
OPENEYE Name: [1-(pentoxymethyl)-2-prop-2-ynoxy-ethyl] carbamate
IUPAC Name: (1-pentoxy-3-prop-2-ynoxypropan-2-yl) carbamate
SYSTEMATIC NAME: (1-pentoxy-3-prop-2-ynoxy-propan-2-yl) carbamate
MOLECULAR FORMULA: C12H21NO4
MOLECULAR WEIGHT: 243.29944
SMILES: CCCCCOCC(COCC#C)OC(=O)N
Structure:
CAS RN: 14668-13-4
CAS Name: acetic acid [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methyl-1-piperidin-1-iumyl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester bromide
OPENEYE Name: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate bromide
IUPAC Name: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate bromide
SYSTEMATIC NAME: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate bromide
MOLECULAR FORMULA: C27H44BrNO3
MOLECULAR WEIGHT: 510.54716
SMILES: CC(=O)O[C@H]1C[C@@H]2CCC3C4CCC(=O)[C@]4(CCC3[C@]2(C[C@@H]1[N+]5(CCCCC5)C)C)C.[Br-]
Structure:
CAS RN: 14668-12-3
CAS Name: acetic acid [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methyl-1-pyrrolidin-1-iumyl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester bromide
OPENEYE Name: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpyrrolidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate bromide
IUPAC Name: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpyrrolidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate bromide
SYSTEMATIC NAME: [(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpyrrolidin-1-ium-1-yl)-17-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate bromide
MOLECULAR FORMULA: C26H42BrNO3
MOLECULAR WEIGHT: 496.52058
SMILES: CC(=O)O[C@H]1C[C@@H]2CCC3C4CCC(=O)[C@]4(CCC3[C@]2(C[C@@H]1[N+]5(CCCC5)C)C)C.[Br-]
Structure:
CAS RN: 14668-11-2
CAS Name: acetic acid [(2S,3S,5S,10S,13S,17S)-2-acetyloxy-10,13-dimethyl-3-(1-methyl-1-piperidin-1-iumyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester hydroxide
OPENEYE Name: [(2S,3S,5S,10S,13S,17S)-2-acetoxy-10,13-dimethyl-3-(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate hydroxide
IUPAC Name: [(2S,3S,5S,10S,13S,17S)-2-acetyloxy-10,13-dimethyl-3-(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate hydroxide
SYSTEMATIC NAME: [(2S,3S,5S,10S,13S,17S)-2-acetyloxy-10,13-dimethyl-3-(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] ethanoate hydroxide
MOLECULAR FORMULA: C29H49NO5
MOLECULAR WEIGHT: 491.70306
SMILES: CC(=O)O[C@H]1CCC2[C@@]1(CCC3C2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)[N+]5(CCCCC5)C)OC(=O)C)C)C.[OH-]
Structure:
CAS RN: 14664-96-1
CAS Name: thiocyanic acid [2,5-dichloro-4-[(2-iodo-1-oxoethyl)amino]phenyl] ester
OPENEYE Name: [2,5-dichloro-4-[(2-iodoacetyl)amino]phenyl] thiocyanate
IUPAC Name: [2,5-dichloro-4-[(2-iodoacetyl)amino]phenyl] thiocyanate
SYSTEMATIC NAME: [2,5-bis(chloranyl)-4-(2-iodanylethanoylamino)phenyl] thiocyanate
MOLECULAR FORMULA: C9H5Cl2IN2OS
MOLECULAR WEIGHT: 387.02427
SMILES: C1=C(C(=CC(=C1Cl)SC#N)Cl)NC(=O)CI
Structure:
CAS RN: 14663-70-8
CAS Name: phosphoric acid (3-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) bis(2,3-dichloropropyl) ester
OPENEYE Name: (3-chloro-4-methyl-2-oxo-chromen-7-yl) bis(2,3-dichloropropyl) phosphate
IUPAC Name: (3-chloro-4-methyl-2-oxochromen-7-yl) bis(2,3-dichloropropyl) phosphate
SYSTEMATIC NAME: bis[2,3-bis(chloranyl)propyl] (3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) phosphate
MOLECULAR FORMULA: C16H16Cl5O6P
MOLECULAR WEIGHT: 512.533401
SMILES: CC1=C(C(=O)OC2=C1C=CC(=C2)OP(=O)(OCC(CCl)Cl)OCC(CCl)Cl)Cl
Structure:
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