CAS RN: 36897-00-4
CAS Name: phenyl-(2,4,5-trimethoxyphenyl)methanone
OPENEYE Name: phenyl-(2,4,5-trimethoxyphenyl)methanone
IUPAC Name: phenyl-(2,4,5-trimethoxyphenyl)methanone
SYSTEMATIC NAME: phenyl-(2,4,5-trimethoxyphenyl)methanone
MOLECULAR FORMULA: C16H16O4
MOLECULAR WEIGHT: 272.29584
SMILES: COC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OC)OC
Structure:
CAS RN: 36873-45-7
CAS Name: 2-formyl-4-pentenoic acid ethyl ester
OPENEYE Name: ethyl 2-formylpent-4-enoate
IUPAC Name: ethyl 2-formylpent-4-enoate
SYSTEMATIC NAME: ethyl 2-methanoylpent-4-enoate
MOLECULAR FORMULA: C8H12O3
MOLECULAR WEIGHT: 156.17908
SMILES: CCOC(=O)C(CC=C)C=O
Structure:
CAS RN: 36798-98-8
CAS Name: 2-chloro-10-phenothiazinecarbonyl chloride
OPENEYE Name: 2-chlorophenothiazine-10-carbonyl chloride
IUPAC Name: 2-chlorophenothiazine-10-carbonyl chloride
SYSTEMATIC NAME: 2-chloranylphenothiazine-10-carbonyl chloride
MOLECULAR FORMULA: C13H7Cl2NOS
MOLECULAR WEIGHT: 296.17178
SMILES: C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)Cl
Structure:
CAS RN: 36796-46-0
CAS Name: 1-methyl-N-phenyl-4-piperidinimine
OPENEYE Name: 1-methyl-N-phenyl-piperidin-4-imine
IUPAC Name: 1-methyl-N-phenylpiperidin-4-imine
SYSTEMATIC NAME: 1-methyl-N-phenyl-piperidin-4-imine
MOLECULAR FORMULA: C12H16N2
MOLECULAR WEIGHT: 188.26884
SMILES: CN1CCC(=NC2=CC=CC=C2)CC1
Structure:
CAS RN: 36765-74-9
CAS Name: 4,4-diphenyl-1-butanamine
OPENEYE Name: 4,4-diphenylbutan-1-amine
IUPAC Name: 4,4-diphenylbutan-1-amine
SYSTEMATIC NAME: 4,4-diphenylbutan-1-amine
MOLECULAR FORMULA: C16H19N
MOLECULAR WEIGHT: 225.32876
SMILES: C1=CC=C(C=C1)C(CCCN)C2=CC=CC=C2
Structure:
CAS RN: 36756-72-6
CAS Name: N,N-di(butan-2-yl)carbamoyl chloride
OPENEYE Name: N,N-disec-butylcarbamoyl chloride
IUPAC Name: N,N-di(butan-2-yl)carbamoyl chloride
SYSTEMATIC NAME: N,N-di(butan-2-yl)carbamoyl chloride
MOLECULAR FORMULA: C9H18ClNO
MOLECULAR WEIGHT: 191.69832
SMILES: CCC(C)N(C(C)CC)C(=O)Cl
Structure:
CAS RN: 36747-99-6
CAS Name: (2-chloro-1-ethoxyethyl)benzene
OPENEYE Name: (2-chloro-1-ethoxy-ethyl)benzene
IUPAC Name: (2-chloro-1-ethoxyethyl)benzene
SYSTEMATIC NAME: (2-chloranyl-1-ethoxy-ethyl)benzene
MOLECULAR FORMULA: C10H13ClO
MOLECULAR WEIGHT: 184.66262
SMILES: CCOC(CCl)C1=CC=CC=C1
Structure:
CAS RN: 36711-69-0
CAS Name: 1,4-dibromo-2,5-bis(dibromomethyl)benzene
OPENEYE Name: 1,4-dibromo-2,5-bis(dibromomethyl)benzene
IUPAC Name: 1,4-dibromo-2,5-bis(dibromomethyl)benzene
SYSTEMATIC NAME: 1,4-bis[bis(bromanyl)methyl]-2,5-bis(bromanyl)benzene
MOLECULAR FORMULA: C8H4Br6
MOLECULAR WEIGHT: 579.54136
SMILES: C1=C(C(=CC(=C1Br)C(Br)Br)Br)C(Br)Br
Structure:
CAS RN: 36699-87-3
CAS Name: 2-hydroxy-3,6-dimethyl-4-oxo-1-cyclohex-2-enecarboxylic acid methyl ester
OPENEYE Name: methyl 2-hydroxy-3,6-dimethyl-4-oxo-cyclohex-2-ene-1-carboxylate
IUPAC Name: methyl 2-hydroxy-3,6-dimethyl-4-oxocyclohex-2-ene-1-carboxylate
SYSTEMATIC NAME: methyl 3,6-dimethyl-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate
MOLECULAR FORMULA: C10H14O4
MOLECULAR WEIGHT: 198.21576
SMILES: CC1CC(=O)C(=C(C1C(=O)OC)O)C
Structure:
CAS RN: 36665-67-5
CAS Name: dodecanoic acid tridecyl ester
OPENEYE Name: tridecyl dodecanoate
IUPAC Name: tridecyl dodecanoate
SYSTEMATIC NAME: tridecyl dodecanoate
MOLECULAR FORMULA: C25H50O2
MOLECULAR WEIGHT: 382.6633
SMILES: CCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
Structure:
CAS RN: 36653-42-6
CAS Name: cyclooctane-1,2,5,6-tetrol
OPENEYE Name: cyclooctane-1,2,5,6-tetrol
IUPAC Name: cyclooctane-1,2,5,6-tetrol
SYSTEMATIC NAME: cyclooctane-1,2,5,6-tetrol
MOLECULAR FORMULA: C8H16O4
MOLECULAR WEIGHT: 176.21024
SMILES: C1CC(C(CCC(C1O)O)O)O
Structure:
CAS RN: 36652-79-6
CAS Name: N-(2-chloroethyl)-2,6-dinitro-4-(trifluoromethyl)aniline
OPENEYE Name: N-(2-chloroethyl)-2,6-dinitro-4-(trifluoromethyl)aniline
IUPAC Name: N-(2-chloroethyl)-2,6-dinitro-4-(trifluoromethyl)aniline
SYSTEMATIC NAME: N-(2-chloroethyl)-2,6-dinitro-4-(trifluoromethyl)aniline
MOLECULAR FORMULA: C9H7ClF3N3O4
MOLECULAR WEIGHT: 313.61779
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])NCCCl)[N+](=O)[O-])C(F)(F)F
Structure:
CAS RN: 36636-14-3
CAS Name: N-[3-hydroxy-4-(methanesulfonamido)phenyl]-2-methyl-2-propenamide
OPENEYE Name: N-[3-hydroxy-4-(methanesulfonamido)phenyl]-2-methyl-prop-2-enamide
IUPAC Name: N-[3-hydroxy-4-(methanesulfonamido)phenyl]-2-methylprop-2-enamide
SYSTEMATIC NAME: 2-methyl-N-[4-(methylsulfonylamino)-3-oxidanyl-phenyl]prop-2-enamide
MOLECULAR FORMULA: C11H14N2O4S
MOLECULAR WEIGHT: 270.30486
SMILES: CC(=C)C(=O)NC1=CC(=C(C=C1)NS(=O)(=O)C)O
Structure:
CAS RN: 36635-35-5
CAS Name: 4,6-dimethyl-1-cyclohex-3-enecarboxaldehyde
OPENEYE Name: 4,6-dimethylcyclohex-3-ene-1-carbaldehyde
IUPAC Name: 4,6-dimethylcyclohex-3-ene-1-carbaldehyde
SYSTEMATIC NAME: 4,6-dimethylcyclohex-3-ene-1-carbaldehyde
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: CC1CC(=CCC1C=O)C
Structure:
CAS RN: 36617-27-3
CAS Name: tetradecanoic acid tridecyl ester
OPENEYE Name: tridecyl tetradecanoate
IUPAC Name: tridecyl tetradecanoate
SYSTEMATIC NAME: tridecyl tetradecanoate
MOLECULAR FORMULA: C27H54O2
MOLECULAR WEIGHT: 410.71646
SMILES: CCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC
Structure:
CAS RN: 36616-28-1
CAS Name: N-[4-(2-chloroethoxy)phenyl]acetamide
OPENEYE Name: N-[4-(2-chloroethoxy)phenyl]acetamide
IUPAC Name: N-[4-(2-chloroethoxy)phenyl]acetamide
SYSTEMATIC NAME: N-[4-(2-chloroethyloxy)phenyl]ethanamide
MOLECULAR FORMULA: C10H12ClNO2
MOLECULAR WEIGHT: 213.66078
SMILES: CC(=O)NC1=CC=C(C=C1)OCCCl
Structure:
CAS RN: 36495-65-5
CAS Name: trimethyl-[1-(1-oxooctadecylamino)propyl]ammonium chloride
OPENEYE Name: trimethyl-[1-(octadecanoylamino)propyl]ammonium chloride
IUPAC Name: trimethyl-[1-(octadecanoylamino)propyl]azanium chloride
SYSTEMATIC NAME: trimethyl-[1-(octadecanoylamino)propyl]azanium chloride
MOLECULAR FORMULA: C24H51ClN2O
MOLECULAR WEIGHT: 419.12754
SMILES: CCCCCCCCCCCCCCCCCC(=O)NC(CC)[N+](C)(C)C.[Cl-]
Structure:
CAS RN: 36412-76-7
CAS Name: 3-[ethyl(dipropyl)silyl]-1-propanamine
OPENEYE Name: 3-[ethyl(dipropyl)silyl]propan-1-amine
IUPAC Name: 3-[ethyl(dipropyl)silyl]propan-1-amine
SYSTEMATIC NAME: 3-[ethyl(dipropyl)silyl]propan-1-amine
MOLECULAR FORMULA: C11H27NSi
MOLECULAR WEIGHT: 201.42428
SMILES: CCC[Si](CC)(CCC)CCCN
Structure:
CAS RN: 36343-02-9
CAS Name: N-propan-2-yl-1-pentanamine
OPENEYE Name: N-isopropylpentan-1-amine
IUPAC Name: N-propan-2-ylpentan-1-amine
SYSTEMATIC NAME: N-propan-2-ylpentan-1-amine
MOLECULAR FORMULA: C8H19N
MOLECULAR WEIGHT: 129.24316
SMILES: CCCCCNC(C)C
Structure:
CAS RN: 36280-77-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H14O
MOLECULAR WEIGHT: 234.29246
SMILES: C1CC2(C3=CC=CC=C3C1C4=CC=CC=C42)C=O
Structure:
CAS RN: 36250-83-6
CAS Name: calcium 2-octadecylbenzenesulfonate
OPENEYE Name: calcium 2-octadecylbenzenesulfonate
IUPAC Name: calcium 2-octadecylbenzenesulfonate
SYSTEMATIC NAME: calcium 2-octadecylbenzenesulfonate
MOLECULAR FORMULA: C24H41CaO3S+
MOLECULAR WEIGHT: 449.72354
SMILES: CCCCCCCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Ca+2]
Structure:
CAS RN: 35996-97-5
CAS Name: pentadecanoic acid butyl ester
OPENEYE Name: butyl pentadecanoate
IUPAC Name: butyl pentadecanoate
SYSTEMATIC NAME: butyl pentadecanoate
MOLECULAR FORMULA: C19H38O2
MOLECULAR WEIGHT: 298.50382
SMILES: CCCCCCCCCCCCCCC(=O)OCCCC
Structure:
CAS RN: 35981-69-2
CAS Name: 2-[4-(cyclopropylmethyl)phenyl]acetic acid
OPENEYE Name: 2-[4-(cyclopropylmethyl)phenyl]acetic acid
IUPAC Name: 2-[4-(cyclopropylmethyl)phenyl]acetic acid
SYSTEMATIC NAME: 2-[4-(cyclopropylmethyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C12H14O2
MOLECULAR WEIGHT: 190.23836
SMILES: C1CC1CC2=CC=C(C=C2)CC(=O)O
Structure:
CAS RN: 35976-46-6
CAS Name: 5-methoxy-1,3,3-trimethyl-2-methyleneindole
OPENEYE Name: 5-methoxy-1,3,3-trimethyl-2-methylene-indoline
IUPAC Name: 5-methoxy-1,3,3-trimethyl-2-methylideneindole
SYSTEMATIC NAME: 5-methoxy-1,3,3-trimethyl-2-methylidene-indole
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: CC1(C(=C)N(C2=C1C=C(C=C2)OC)C)C
Structure:
CAS RN: 35974-37-9
CAS Name: 2-(2-pyridinyloxy)phenol
OPENEYE Name: 2-(2-pyridyloxy)phenol
IUPAC Name: 2-pyridin-2-yloxyphenol
SYSTEMATIC NAME: 2-pyridin-2-yloxyphenol
MOLECULAR FORMULA: C11H9NO2
MOLECULAR WEIGHT: 187.19466
SMILES: C1=CC=C(C(=C1)O)OC2=CC=CC=N2
Structure:
CAS RN: 35954-85-9
CAS Name: 4-(2,4-dinitrophenyl)azo-N-ethyl-N-[2-[1-(2-methylpropoxy)ethoxy]ethyl]aniline
OPENEYE Name: 4-(2,4-dinitrophenyl)azo-N-ethyl-N-[2-(1-isobutoxyethoxy)ethyl]aniline
IUPAC Name: 4-[(2,4-dinitrophenyl)diazenyl]-N-ethyl-N-[2-[1-(2-methylpropoxy)ethoxy]ethyl]aniline
SYSTEMATIC NAME: 4-[(2,4-dinitrophenyl)diazenyl]-N-ethyl-N-[2-[1-(2-methylpropoxy)ethoxy]ethyl]aniline
MOLECULAR FORMULA: C22H29N5O6
MOLECULAR WEIGHT: 459.49556
SMILES: CCN(CCOC(C)OCC(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 35950-41-5
CAS Name: 2-nitro-5-(2-nitroprop-2-enyl)furan
OPENEYE Name: 2-nitro-5-(2-nitroallyl)furan
IUPAC Name: 2-nitro-5-(2-nitroprop-2-enyl)furan
SYSTEMATIC NAME: 2-nitro-5-(2-nitroprop-2-enyl)furan
MOLECULAR FORMULA: C7H6N2O5
MOLECULAR WEIGHT: 198.13294
SMILES: C=C(CC1=CC=C(O1)[N+](=O)[O-])[N+](=O)[O-]
Structure:
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