CAS RN: 14334-41-9
CAS Name: 4,4-diphenyl-N-propan-2-yl-1-cyclohexanamine hydrochloride
OPENEYE Name: N-isopropyl-4,4-diphenyl-cyclohexanamine hydrochloride
IUPAC Name: 4,4-diphenyl-N-propan-2-ylcyclohexan-1-amine hydrochloride
SYSTEMATIC NAME: 4,4-diphenyl-N-propan-2-yl-cyclohexan-1-amine hydrochloride
MOLECULAR FORMULA: C21H28ClN
MOLECULAR WEIGHT: 329.90672
SMILES: CC(C)NC1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:
CAS RN: 14252-32-5
CAS Name: 1-phenyl-1-hexyn-3-one
OPENEYE Name: 1-phenylhex-1-yn-3-one
IUPAC Name: 1-phenylhex-1-yn-3-one
SYSTEMATIC NAME: 1-phenylhex-1-yn-3-one
MOLECULAR FORMULA: C12H12O
MOLECULAR WEIGHT: 172.22308
SMILES: CCCC(=O)C#CC1=CC=CC=C1
Structure:
CAS RN: 14101-95-2
CAS Name: chloro-tri(propan-2-yl)stannane
OPENEYE Name: chloro(triisopropyl)stannane
IUPAC Name: chloro-tri(propan-2-yl)stannane
SYSTEMATIC NAME: chloranyl-tri(propan-2-yl)stannane
MOLECULAR FORMULA: C9H21ClSn
MOLECULAR WEIGHT: 283.42604
SMILES: CC(C)[Sn](C(C)C)(C(C)C)Cl
Structure:
CAS RN: 13903-43-0
CAS Name: (2S,3R,11bS)-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine dihydrobromide
OPENEYE Name: (2S,3R,11bS)-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine dihydrobromide
IUPAC Name: (2S,3R,11bS)-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine dihydrobromide
SYSTEMATIC NAME: (2S,3R,11bS)-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine dihydrobromide
MOLECULAR FORMULA: C29H42Br2N2O4
MOLECULAR WEIGHT: 642.46278
SMILES: CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1CC4C5=CC(=C(C=C5CCN4)OC)OC)OC)OC.Br.Br
Structure:
CAS RN: 13748-79-3
CAS Name: 2-(carbamoylamino)oxypropanoic acid methyl ester
OPENEYE Name: methyl 2-ureidooxypropanoate
IUPAC Name: methyl 2-(carbamoylamino)oxypropanoate
SYSTEMATIC NAME: methyl 2-(aminocarbonylamino)oxypropanoate
MOLECULAR FORMULA: C5H10N2O4
MOLECULAR WEIGHT: 162.1439
SMILES: CC(C(=O)OC)ONC(=O)N
Structure:
CAS RN: 13619-98-2
CAS Name: 1-[2-[4-(7-methoxy-3-phenyl-2H-1-benzopyran-4-yl)phenoxy]ethyl]pyrrolidine
OPENEYE Name: 1-[2-[4-(7-methoxy-3-phenyl-2H-chromen-4-yl)phenoxy]ethyl]pyrrolidine
IUPAC Name: 1-[2-[4-(7-methoxy-3-phenyl-2H-chromen-4-yl)phenoxy]ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-[4-(7-methoxy-3-phenyl-2H-chromen-4-yl)phenoxy]ethyl]pyrrolidine
MOLECULAR FORMULA: C28H29NO3
MOLECULAR WEIGHT: 427.53476
SMILES: COC1=CC2=C(C=C1)C(=C(CO2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5
Structure:
CAS RN: 3670-65-3
CAS Name: 3-(1-azepanyl)-1-(3-nitrophenyl)-1-propanone
OPENEYE Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one
IUPAC Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one
SYSTEMATIC NAME: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one
MOLECULAR FORMULA: C15H20N2O3
MOLECULAR WEIGHT: 276.3309
SMILES: C1CCCN(CC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]
Structure:
CAS RN: 13492-21-2
CAS Name: 3-(1-azepanyl)-1-(3-nitrophenyl)-1-propanone hydrochloride
OPENEYE Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride
IUPAC Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride
SYSTEMATIC NAME: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride
MOLECULAR FORMULA: C15H21ClN2O3
MOLECULAR WEIGHT: 312.79184
SMILES: C1CCCN(CC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl
Structure:
CAS RN: 13483-03-9
CAS Name: 4,5-dihydrothiazol-2-amine hydrobromide
OPENEYE Name: 4,5-dihydrothiazol-2-amine hydrobromide
IUPAC Name: 4,5-dihydro-1,3-thiazol-2-amine hydrobromide
SYSTEMATIC NAME: 4,5-dihydro-1,3-thiazol-2-amine hydrobromide
MOLECULAR FORMULA: C3H7BrN2S
MOLECULAR WEIGHT: 183.07008
SMILES: C1CSC(=N1)N.Br
Structure:
CAS RN: 13450-84-5
CAS Name: gadolinium(3+) trichloride hexahydrate
OPENEYE Name: gadolinium(3+) trichloride hexahydrate
IUPAC Name: gadolinium(3+) trichloride hexahydrate
SYSTEMATIC NAME: gadolinium(3+) trichloride hexahydrate
MOLECULAR FORMULA: Cl3GdH12O6
MOLECULAR WEIGHT: 371.70068
SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Gd+3]
Structure:
CAS RN: 13213-86-0
CAS Name: 6-chloro-4-phenyl-1,4-dihydro-3,1-benzoxazin-2-one
OPENEYE Name: 6-chloro-4-phenyl-1,4-dihydro-3,1-benzoxazin-2-one
IUPAC Name: 6-chloro-4-phenyl-1,4-dihydro-3,1-benzoxazin-2-one
SYSTEMATIC NAME: 6-chloranyl-4-phenyl-1,4-dihydro-3,1-benzoxazin-2-one
MOLECULAR FORMULA: C14H10ClNO2
MOLECULAR WEIGHT: 259.6877
SMILES: C1=CC=C(C=C1)C2C3=C(C=CC(=C3)Cl)NC(=O)O2
Structure:
CAS RN: 13142-86-4
CAS Name: (3-ethoxyphenyl)urea
OPENEYE Name: (3-ethoxyphenyl)urea
IUPAC Name: (3-ethoxyphenyl)urea
SYSTEMATIC NAME: 1-(3-ethoxyphenyl)urea
MOLECULAR FORMULA: C9H12N2O2
MOLECULAR WEIGHT: 180.20378
SMILES: CCOC1=CC=CC(=C1)NC(=O)N
Structure:
CAS RN: 13078-76-7
CAS Name: 2-(3,4-dimethoxyphenyl)-N-methylethanamine hydrochloride
OPENEYE Name: 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine hydrochloride
IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-methylethanamine hydrochloride
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine hydrochloride
MOLECULAR FORMULA: C11H18ClNO2
MOLECULAR WEIGHT: 231.71912
SMILES: CNCCC1=CC(=C(C=C1)OC)OC.Cl
Structure:
CAS RN: 13046-10-1
CAS Name: [2-[bis(sulfomethyl)amino]ethyl-(sulfomethyl)amino]methanesulfonic acid
OPENEYE Name: [2-[bis(sulfomethyl)amino]ethyl-(sulfomethyl)amino]methanesulfonic acid
IUPAC Name: [2-[bis(sulfomethyl)amino]ethyl-(sulfomethyl)amino]methanesulfonic acid
SYSTEMATIC NAME: [2-[bis(sulfomethyl)amino]ethyl-(sulfomethyl)amino]methanesulfonic acid
MOLECULAR FORMULA: C6H16N2O12S4
MOLECULAR WEIGHT: 436.45744
SMILES: C(CN(CS(=O)(=O)O)CS(=O)(=O)O)N(CS(=O)(=O)O)CS(=O)(=O)O
Structure:
CAS RN: 13046-10-1
CAS Name: tetrasodium [2-[bis(sulfonatomethyl)amino]ethyl-(sulfonatomethyl)amino]methanesulfonate
OPENEYE Name: tetrasodium [2-[bis(sulfonatomethyl)amino]ethyl-(sulfonatomethyl)amino]methanesulfonate
IUPAC Name: tetrasodium [2-[bis(sulfonatomethyl)amino]ethyl-(sulfonatomethyl)amino]methanesulfonate
SYSTEMATIC NAME: tetrasodium [2-[bis(sulfonatomethyl)amino]ethyl-(sulfonatomethyl)amino]methanesulfonate
MOLECULAR FORMULA: C6H12N2Na4O12S4
MOLECULAR WEIGHT: 524.38476
SMILES: C(CN(CS(=O)(=O)[O-])CS(=O)(=O)[O-])N(CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 12271-70-4
CAS Name: barium(2+) arsorate fluoride
OPENEYE Name: barium(2+) arsorate fluoride
IUPAC Name: barium(2+) arsorate fluoride
SYSTEMATIC NAME: barium(2+) arsorate fluoride
MOLECULAR FORMULA: AsBa2FO4
MOLECULAR WEIGHT: 432.571603
SMILES: [O-][As](=O)([O-])[O-].[F-].[Ba+2].[Ba+2]
Structure:
CAS RN: 12249-63-7
CAS Name: sulfanylidenesilver
OPENEYE Name: thioxosilver
IUPAC Name: sulfanylidenesilver
SYSTEMATIC NAME: sulfanylidenesilver
MOLECULAR FORMULA: AgS
MOLECULAR WEIGHT: 139.9332
SMILES: S=[Ag]
Structure:
CAS RN: 12089-29-1
CAS Name: benzene; chromium; iodide
OPENEYE Name: benzene; chromium; iodide
IUPAC Name: benzene; chromium; iodide
SYSTEMATIC NAME: benzene; chromium; iodide
MOLECULAR FORMULA: C12H12CrI-
MOLECULAR WEIGHT: 335.12425
SMILES: C1=CC=CC=C1.C1=CC=CC=C1.[Cr].[I-]
Structure:
CAS RN: 12058-74-1
CAS Name: disodium; oxygen(2-); vanadium
OPENEYE Name: disodium; oxygen(2-); vanadium
IUPAC Name: disodium; oxygen(2-); vanadium
SYSTEMATIC NAME: disodium; oxygen(2-); vanadium
MOLECULAR FORMULA: Na2O11V4-20
MOLECULAR WEIGHT: 425.73894
SMILES: [O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[V].[V].[V].[V]
Structure:
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