CAS RN: 28383-15-5
CAS Name: 1-(1,2-diphenylethyl)piperidine hydrochloride
OPENEYE Name: 1-(1,2-diphenylethyl)piperidine hydrochloride
IUPAC Name: 1-(1,2-diphenylethyl)piperidine hydrochloride
SYSTEMATIC NAME: 1-(1,2-diphenylethyl)piperidine hydrochloride
MOLECULAR FORMULA: C19H24ClN
MOLECULAR WEIGHT: 301.85356
SMILES: C1CCN(CC1)C(CC2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:
CAS RN: 28379-57-9
CAS Name: (7S)-7-hydroxy-6,7-dihydro-5H-pyrrolizine-1-carboxaldehyde
OPENEYE Name: (7S)-7-hydroxy-6,7-dihydro-5H-pyrrolizine-1-carbaldehyde
IUPAC Name: (7S)-7-hydroxy-6,7-dihydro-5H-pyrrolizine-1-carbaldehyde
SYSTEMATIC NAME: (7S)-7-oxidanyl-6,7-dihydro-5H-pyrrolizine-1-carbaldehyde
MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: C1CN2C=CC(=C2[C@H]1O)C=O
Structure:
CAS RN: 28379-55-7
CAS Name: (1R)-7-methyl-2,3-dihydro-1H-pyrrolizin-1-ol
OPENEYE Name: (1R)-7-methyl-2,3-dihydro-1H-pyrrolizin-1-ol
IUPAC Name: (1R)-7-methyl-2,3-dihydro-1H-pyrrolizin-1-ol
SYSTEMATIC NAME: (1R)-7-methyl-2,3-dihydro-1H-pyrrolizin-1-ol
MOLECULAR FORMULA: C8H11NO
MOLECULAR WEIGHT: 137.17904
SMILES: CC1=C2[C@@H](CCN2C=C1)O
Structure:
CAS RN: 28371-51-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H30O5
MOLECULAR WEIGHT: 350.4492
SMILES: C[C@]1(CC23CC(=O)[C@]4([C@@H](C[C@@H](C4(C)C)O)C(=C)[C@@H]2CCC1[C@@H]3O)O)O
Structure:
CAS RN: 28362-31-4
CAS Name: (4-borono-2-nitrophenyl)boronic acid
OPENEYE Name: (4-borono-2-nitro-phenyl)boronic acid
IUPAC Name: (4-borono-2-nitrophenyl)boronic acid
SYSTEMATIC NAME: [4-(dihydroxyboranyl)-2-nitro-phenyl]boronic acid
MOLECULAR FORMULA: C6H7B2NO6
MOLECULAR WEIGHT: 210.74488
SMILES: B(C1=CC(=C(C=C1)B(O)O)[N+](=O)[O-])(O)O
Structure:
CAS RN: 28358-28-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H25ClN2OS
MOLECULAR WEIGHT: 328.9005
SMILES: CCC1=C(SC2=NC3(CCCC3C4(N12)CCCC4)O)C.Cl
Structure:
CAS RN: 28358-26-1
CAS Name: 3-ethyl-2,5,5,7-tetramethyl-6H-thiazolo[3,2-a]pyrimidin-7-ol hydrochloride
OPENEYE Name: 3-ethyl-2,5,5,7-tetramethyl-6H-thiazolo[3,2-a]pyrimidin-7-ol hydrochloride
IUPAC Name: 3-ethyl-2,5,5,7-tetramethyl-6H-[1,3]thiazolo[3,2-a]pyrimidin-7-ol hydrochloride
SYSTEMATIC NAME: 3-ethyl-2,5,5,7-tetramethyl-6H-[1,3]thiazolo[3,2-a]pyrimidin-7-ol hydrochloride
MOLECULAR FORMULA: C12H21ClN2OS
MOLECULAR WEIGHT: 276.82594
SMILES: CCC1=C(SC2=NC(CC(N12)(C)C)(C)O)C.Cl
Structure:
CAS RN: 28358-21-6
CAS Name: 2-chlorobenzoic acid; 2-spiro[5,6,7,8-tetrahydro-3,1-benzothiazine-4,1'-cyclohexane]amine
OPENEYE Name: 2-chlorobenzoic acid; spiro[5,6,7,8-tetrahydro-3,1-benzothiazine-4,1'-cyclohexane]-2-amine
IUPAC Name: 2-chlorobenzoic acid; spiro[5,6,7,8-tetrahydro-3,1-benzothiazine-4,1'-cyclohexane]-2-amine
SYSTEMATIC NAME: 2-chloranylbenzoic acid; spiro[5,6,7,8-tetrahydro-3,1-benzothiazine-4,1'-cyclohexane]-2-amine
MOLECULAR FORMULA: C20H25ClN2O2S
MOLECULAR WEIGHT: 392.9427
SMILES: C1CCC2(CC1)C3=C(CCCC3)N=C(S2)N.C1=CC=C(C(=C1)C(=O)O)Cl
Structure:
CAS RN: 28347-83-3
CAS Name: diammonium; oxygen(2-); uranium; hydrate
OPENEYE Name: diammonium; oxygen(2-); uranium; hydrate
IUPAC Name: diazanium; oxygen(2-); uranium; hydrate
SYSTEMATIC NAME: diazanium; oxygen(2-); uranium; hydrate
MOLECULAR FORMULA: H10N2O5U-6
MOLECULAR WEIGHT: 356.11871
SMILES: [NH4+].[NH4+].O.[O-2].[O-2].[O-2].[O-2].[U]
Structure:
CAS RN: 28345-99-5
CAS Name: 1,3-dimethyl-8-(3-pyridinylmethyl)-7H-purine-2,6-dione
OPENEYE Name: 1,3-dimethyl-8-(3-pyridylmethyl)-7H-purine-2,6-dione
IUPAC Name: 1,3-dimethyl-8-(pyridin-3-ylmethyl)-7H-purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-(pyridin-3-ylmethyl)-7H-purine-2,6-dione
MOLECULAR FORMULA: C13H13N5O2
MOLECULAR WEIGHT: 271.27462
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CC3=CN=CC=C3
Structure:
CAS RN: 28345-98-4
CAS Name: 2-[1,3-dimethyl-2,6-dioxo-8-(3-pyridinylmethyl)-7-purinyl]acetic acid
OPENEYE Name: 2-[1,3-dimethyl-2,6-dioxo-8-(3-pyridylmethyl)purin-7-yl]acetic acid
IUPAC Name: 2-[1,3-dimethyl-2,6-dioxo-8-(pyridin-3-ylmethyl)purin-7-yl]acetic acid
SYSTEMATIC NAME: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)-8-(pyridin-3-ylmethyl)purin-7-yl]ethanoic acid
MOLECULAR FORMULA: C15H15N5O4
MOLECULAR WEIGHT: 329.3107
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CN=CC=C3)CC(=O)O
Structure:
CAS RN: 28345-97-3
CAS Name: 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-(3-pyridinylmethyl)purine-2,6-dione
OPENEYE Name: 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-(3-pyridylmethyl)purine-2,6-dione
IUPAC Name: 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-(pyridin-3-ylmethyl)purine-2,6-dione
SYSTEMATIC NAME: 7-[2,3-bis(oxidanyl)propyl]-1,3-dimethyl-8-(pyridin-3-ylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C16H19N5O4
MOLECULAR WEIGHT: 345.35316
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CN=CC=C3)CC(CO)O
Structure:
CAS RN: 28345-96-2
CAS Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(3-pyridinylmethyl)purine-2,6-dione
OPENEYE Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(3-pyridylmethyl)purine-2,6-dione
IUPAC Name: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(pyridin-3-ylmethyl)purine-2,6-dione
SYSTEMATIC NAME: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(pyridin-3-ylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C15H17N5O3
MOLECULAR WEIGHT: 315.32718
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CN=CC=C3)CCO
Structure:
CAS RN: 28338-31-0
CAS Name: carbamic acid (4-tert-butyl-2-prop-2-enylphenyl) ester
OPENEYE Name: (2-allyl-4-tert-butyl-phenyl) carbamate
IUPAC Name: (4-tert-butyl-2-prop-2-enylphenyl) carbamate
SYSTEMATIC NAME: (4-tert-butyl-2-prop-2-enyl-phenyl) carbamate
MOLECULAR FORMULA: C14H19NO2
MOLECULAR WEIGHT: 233.30616
SMILES: CC(C)(C)C1=CC(=C(C=C1)OC(=O)N)CC=C
Structure:
CAS RN: 28338-29-6
CAS Name: carbamic acid (3-tert-butylphenyl) ester
OPENEYE Name: (3-tert-butylphenyl) carbamate
IUPAC Name: (3-tert-butylphenyl) carbamate
SYSTEMATIC NAME: (3-tert-butylphenyl) carbamate
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CC(C)(C)C1=CC(=CC=C1)OC(=O)N
Structure:
CAS RN: 28338-28-5
CAS Name: carbamic acid (2-tert-butylphenyl) ester
OPENEYE Name: (2-tert-butylphenyl) carbamate
IUPAC Name: (2-tert-butylphenyl) carbamate
SYSTEMATIC NAME: (2-tert-butylphenyl) carbamate
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CC(C)(C)C1=CC=CC=C1OC(=O)N
Structure:
CAS RN: 28338-27-4
CAS Name: carbamic acid (2-tert-butyl-6-prop-2-enylphenyl) ester
OPENEYE Name: (2-allyl-6-tert-butyl-phenyl) carbamate
IUPAC Name: (2-tert-butyl-6-prop-2-enylphenyl) carbamate
SYSTEMATIC NAME: (2-tert-butyl-6-prop-2-enyl-phenyl) carbamate
MOLECULAR FORMULA: C14H19NO2
MOLECULAR WEIGHT: 233.30616
SMILES: CC(C)(C)C1=CC=CC(=C1OC(=O)N)CC=C
Structure:
CAS RN: 28335-55-9
CAS Name: 6-dimethylsulfoniohexyl(dimethyl)sulfonium dibromide
OPENEYE Name: 6-dimethylsulfoniohexyl(dimethyl)sulfonium dibromide
IUPAC Name: 6-dimethylsulfoniohexyl(dimethyl)sulfanium dibromide
SYSTEMATIC NAME: 6-dimethylsulfoniohexyl(dimethyl)sulfanium dibromide
MOLECULAR FORMULA: C10H24Br2S2
MOLECULAR WEIGHT: 368.23556
SMILES: C[S+](C)CCCCCC[S+](C)C.[Br-].[Br-]
Structure:
CAS RN: 28331-20-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H22BrNO
MOLECULAR WEIGHT: 312.24528
SMILES: C[C@@]12CCCN(C(C1)CC3=C2C=C(C=C3)O)C.Br
Structure:
CAS RN: 28330-19-0
CAS Name: 2-oxo-5-(prop-2-ynoxymethyl)-3-oxolanecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-oxo-5-(prop-2-ynoxymethyl)tetrahydrofuran-3-carboxylate
IUPAC Name: ethyl 2-oxo-5-(prop-2-ynoxymethyl)oxolane-3-carboxylate
SYSTEMATIC NAME: ethyl 2-oxidanylidene-5-(prop-2-ynoxymethyl)oxolane-3-carboxylate
MOLECULAR FORMULA: C11H14O5
MOLECULAR WEIGHT: 226.22586
SMILES: CCOC(=O)C1CC(OC1=O)COCC#C
Structure:
CAS RN: 28329-34-2
CAS Name: 4-methyl-1-piperazinecarboxylic acid (3-tert-butylphenyl) ester
OPENEYE Name: (3-tert-butylphenyl) 4-methylpiperazine-1-carboxylate
IUPAC Name: (3-tert-butylphenyl) 4-methylpiperazine-1-carboxylate
SYSTEMATIC NAME: (3-tert-butylphenyl) 4-methylpiperazine-1-carboxylate
MOLECULAR FORMULA: C16H24N2O2
MOLECULAR WEIGHT: 276.37396
SMILES: CC(C)(C)C1=CC(=CC=C1)OC(=O)N2CCN(CC2)C
Structure:
CAS RN: 28321-38-2
CAS Name: 2-ethyl-4,6-bis(1-piperidinyl)-1,3,5-triazine
OPENEYE Name: 2-ethyl-4,6-bis(1-piperidyl)-1,3,5-triazine
IUPAC Name: 2-ethyl-4,6-di(piperidin-1-yl)-1,3,5-triazine
SYSTEMATIC NAME: 2-ethyl-4,6-di(piperidin-1-yl)-1,3,5-triazine
MOLECULAR FORMULA: C15H25N5
MOLECULAR WEIGHT: 275.3925
SMILES: CCC1=NC(=NC(=N1)N2CCCCC2)N3CCCCC3
Structure:
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