CAS RN: 85523-08-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H23N
MOLECULAR WEIGHT: 217.34982
SMILES: C1CCN(C1)C2C3CCCC2C4CC3C=C4
Structure:
CAS RN: 85523-07-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H18O
MOLECULAR WEIGHT: 178.27072
SMILES: COC1C2CCCC1C3CC2C=C3
Structure:
CAS RN: 85523-06-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H18O
MOLECULAR WEIGHT: 166.26002
SMILES: C1CC2C3CCC(C3)C(C1)C2O
Structure:
CAS RN: 85523-04-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H16
MOLECULAR WEIGHT: 148.24474
SMILES: C1CC2CC(C1)C3CC2C=C3
Structure:
CAS RN: 85440-70-6
CAS Name: acetic acid (4-acetyloxy-3-oxolanyl) ester
OPENEYE Name: (4-acetoxytetrahydrofuran-3-yl) acetate
IUPAC Name: (4-acetyloxyoxolan-3-yl) acetate
SYSTEMATIC NAME: (4-acetyloxyoxolan-3-yl) ethanoate
MOLECULAR FORMULA: C8H12O5
MOLECULAR WEIGHT: 188.17788
SMILES: CC(=O)OC1COCC1OC(=O)C
Structure:
CAS RN: 85419-40-5
CAS Name: N-(3-chloro-4-methylphenyl)carbamic acid ethyl ester
OPENEYE Name: ethyl N-(3-chloro-4-methyl-phenyl)carbamate
IUPAC Name: ethyl N-(3-chloro-4-methylphenyl)carbamate
SYSTEMATIC NAME: ethyl N-(3-chloranyl-4-methyl-phenyl)carbamate
MOLECULAR FORMULA: C10H12ClNO2
MOLECULAR WEIGHT: 213.66078
SMILES: CCOC(=O)NC1=CC(=C(C=C1)C)Cl
Structure:
CAS RN: 85298-04-0
CAS Name: 2,3-di(propan-2-yl)butanedinitrile
OPENEYE Name: 2,3-diisopropylbutanedinitrile
IUPAC Name: 2,3-di(propan-2-yl)butanedinitrile
SYSTEMATIC NAME: 2,3-di(propan-2-yl)butanedinitrile
MOLECULAR FORMULA: C10H16N2
MOLECULAR WEIGHT: 164.24744
SMILES: CC(C)C(C#N)C(C#N)C(C)C
Structure:
CAS RN: 85229-65-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H17N
MOLECULAR WEIGHT: 163.25938
SMILES: C1CC2C3CC(C=C3)C(C1)C2N
Structure:
CAS RN: 85219-14-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H19N
MOLECULAR WEIGHT: 165.27526
SMILES: C1CC2C3CCC(C3)C(C1)C2N
Structure:
CAS RN: 10102-43-9
CAS Name: nitric oxide
OPENEYE Name: nitric oxide
IUPAC Name: nitric oxide
SYSTEMATIC NAME: nitric oxide
MOLECULAR FORMULA: NO
MOLECULAR WEIGHT: 30.0061
SMILES: [N]=O
Structure:
CAS RN: 85191-11-3
CAS Name: 3-[4,6,8-tris(3-aminopropyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]-1-propanamine
OPENEYE Name: 3-[4,6,8-tris(3-aminopropyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]propan-1-amine
IUPAC Name: 3-[4,6,8-tris(3-aminopropyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]propan-1-amine
SYSTEMATIC NAME: 3-[4,6,8-tris(3-azanylpropyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]propan-1-amine
MOLECULAR FORMULA: C16H44N4O4Si4
MOLECULAR WEIGHT: 468.88696
SMILES: C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCN)(C)CCCN)(C)CCCN)CCCN
Structure:
CAS RN: 85152-89-2
CAS Name: 1,1,3,3-tetraethoxypropa-1,2-diene
OPENEYE Name: 1,1,3,3-tetraethoxyallene
IUPAC Name: 1,1,3,3-tetraethoxypropa-1,2-diene
SYSTEMATIC NAME: 1,1,3,3-tetraethoxypropa-1,2-diene
MOLECULAR FORMULA: C11H20O4
MOLECULAR WEIGHT: 216.2741
SMILES: CCOC(=C=C(OCC)OCC)OCC
Structure:
CAS RN: 85131-86-8
CAS Name: 1,6-dibromo-2,3,5-trichloro-1,1,2,3,4,4,5,6,6-nonafluorohexane
OPENEYE Name: 1,6-dibromo-2,3,5-trichloro-1,1,2,3,4,4,5,6,6-nonafluoro-hexane
IUPAC Name: 1,6-dibromo-2,3,5-trichloro-1,1,2,3,4,4,5,6,6-nonafluorohexane
SYSTEMATIC NAME: 1,6-bis(bromanyl)-2,3,5-tris(chloranyl)-1,1,2,3,4,4,5,6,6-nonakis(fluoranyl)hexane
MOLECULAR FORMULA: C6Br2Cl3F9
MOLECULAR WEIGHT: 509.216829
SMILES: C(C(C(C(F)(F)Br)(F)Cl)(F)Cl)(C(C(F)(F)Br)(F)Cl)(F)F
Structure:
CAS RN: 85031-41-0
CAS Name: N-[6-(2-cyanoethyl)-1-cyclohexenyl]-N-(phenylmethyl)pentanamide
OPENEYE Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]pentanamide
IUPAC Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]pentanamide
SYSTEMATIC NAME: N-[6-(2-cyanoethyl)cyclohexen-1-yl]-N-(phenylmethyl)pentanamide
MOLECULAR FORMULA: C21H28N2O
MOLECULAR WEIGHT: 324.45982
SMILES: CCCCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N
Structure:
CAS RN: 85028-86-0
CAS Name: (2,4,6-tritert-butylphenyl)-(2,4,6-trimethylphenyl)phosphinylidenephosphine
OPENEYE Name: (2,4,6-tritert-butylphenyl)-(2,4,6-trimethylphenyl)phosphanylidene-phosphane
IUPAC Name: (2,4,6-tritert-butylphenyl)-(2,4,6-trimethylphenyl)phosphanylidenephosphane
SYSTEMATIC NAME: (2,4,6-tritert-butylphenyl)-(2,4,6-trimethylphenyl)phosphanylidene-phosphane
MOLECULAR FORMULA: C27H40P2
MOLECULAR WEIGHT: 426.554022
SMILES: CC1=CC(=C(C(=C1)C)P=PC2=C(C=C(C=C2C(C)(C)C)C(C)(C)C)C(C)(C)C)C
Structure:
CAS RN: 85019-65-4
CAS Name: N-[6-(2-cyanoethyl)-1-cyclohexenyl]-2-methyl-N-(phenylmethyl)propanamide
OPENEYE Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]-2-methyl-propanamide
IUPAC Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]-2-methylpropanamide
SYSTEMATIC NAME: N-[6-(2-cyanoethyl)cyclohexen-1-yl]-2-methyl-N-(phenylmethyl)propanamide
MOLECULAR FORMULA: C20H26N2O
MOLECULAR WEIGHT: 310.43324
SMILES: CC(C)C(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N
Structure:
CAS RN: 85019-64-3
CAS Name: N-[6-(2-cyanoethyl)-1-cyclohexenyl]-3-methyl-N-(phenylmethyl)butanamide
OPENEYE Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]-3-methyl-butanamide
IUPAC Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]-3-methylbutanamide
SYSTEMATIC NAME: N-[6-(2-cyanoethyl)cyclohexen-1-yl]-3-methyl-N-(phenylmethyl)butanamide
MOLECULAR FORMULA: C21H28N2O
MOLECULAR WEIGHT: 324.45982
SMILES: CC(C)CC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N
Structure:
CAS RN: 85019-63-2
CAS Name: N-[6-(2-cyanoethyl)-1-cyclohexenyl]-N-(phenylmethyl)butanamide
OPENEYE Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]butanamide
IUPAC Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]butanamide
SYSTEMATIC NAME: N-[6-(2-cyanoethyl)cyclohexen-1-yl]-N-(phenylmethyl)butanamide
MOLECULAR FORMULA: C20H26N2O
MOLECULAR WEIGHT: 310.43324
SMILES: CCCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N
Structure:
CAS RN: 85019-62-1
CAS Name: N-[6-(2-cyanoethyl)-1-cyclohexenyl]-N-(phenylmethyl)propanamide
OPENEYE Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]propanamide
IUPAC Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohexen-1-yl]propanamide
SYSTEMATIC NAME: N-[6-(2-cyanoethyl)cyclohexen-1-yl]-N-(phenylmethyl)propanamide
MOLECULAR FORMULA: C19H24N2O
MOLECULAR WEIGHT: 296.40666
SMILES: CCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N
Structure:
CAS RN: 85017-60-3
CAS Name: 1-iodo-4-pentylbenzene
OPENEYE Name: 1-iodo-4-pentyl-benzene
IUPAC Name: 1-iodo-4-pentylbenzene
SYSTEMATIC NAME: 1-iodanyl-4-pentyl-benzene
MOLECULAR FORMULA: C11H15I
MOLECULAR WEIGHT: 274.14127
SMILES: CCCCCC1=CC=C(C=C1)I
Structure:
CAS RN: 84905-06-6
CAS Name: 1,8-diazabicyclo[6.3.2]tridecane
OPENEYE Name: 1,8-diazabicyclo[6.3.2]tridecane
IUPAC Name: 1,8-diazabicyclo[6.3.2]tridecane
SYSTEMATIC NAME: 1,8-diazabicyclo[6.3.2]tridecane
MOLECULAR FORMULA: C11H22N2
MOLECULAR WEIGHT: 182.30578
SMILES: C1CCCN2CCCN(CC1)CC2
Structure:
CAS RN: 84905-04-4
CAS Name: 1,8-diazabicyclo[6.5.3]hexadecane
OPENEYE Name: 1,8-diazabicyclo[6.5.3]hexadecane
IUPAC Name: 1,8-diazabicyclo[6.5.3]hexadecane
SYSTEMATIC NAME: 1,8-diazabicyclo[6.5.3]hexadecane
MOLECULAR FORMULA: C14H28N2
MOLECULAR WEIGHT: 224.38552
SMILES: C1CCCN2CCCCCN(CC1)CCC2
Structure:
CAS RN: 84905-03-3
CAS Name: 1,8-diazabicyclo[6.4.3]pentadecane
OPENEYE Name: 1,8-diazabicyclo[6.4.3]pentadecane
IUPAC Name: 1,8-diazabicyclo[6.4.3]pentadecane
SYSTEMATIC NAME: 1,8-diazabicyclo[6.4.3]pentadecane
MOLECULAR FORMULA: C13H26N2
MOLECULAR WEIGHT: 210.35894
SMILES: C1CCCN2CCCCN(CC1)CCC2
Structure:
CAS RN: 84905-02-2
CAS Name: 1,7-diazabicyclo[5.5.3]pentadecane
OPENEYE Name: 1,7-diazabicyclo[5.5.3]pentadecane
IUPAC Name: 1,7-diazabicyclo[5.5.3]pentadecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.5.3]pentadecane
MOLECULAR FORMULA: C13H26N2
MOLECULAR WEIGHT: 210.35894
SMILES: C1CCN2CCCCCN(CC1)CCC2
Structure:
CAS RN: 84905-01-1
CAS Name: 1,7-diazabicyclo[5.4.3]tetradecane
OPENEYE Name: 1,7-diazabicyclo[5.4.3]tetradecane
IUPAC Name: 1,7-diazabicyclo[5.4.3]tetradecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.4.3]tetradecane
MOLECULAR FORMULA: C12H24N2
MOLECULAR WEIGHT: 196.33236
SMILES: C1CCN2CCCCN(CC1)CCC2
Structure:
CAS RN: 84905-00-0
CAS Name: 1,7-diazabicyclo[5.5.2]tetradecane
OPENEYE Name: 1,7-diazabicyclo[5.5.2]tetradecane
IUPAC Name: 1,7-diazabicyclo[5.5.2]tetradecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.5.2]tetradecane
MOLECULAR FORMULA: C12H24N2
MOLECULAR WEIGHT: 196.33236
SMILES: C1CCN2CCCCCN(CC1)CC2
Structure:
CAS RN: 84904-99-4
CAS Name: 1,7-diazabicyclo[5.4.2]tridecane
OPENEYE Name: 1,7-diazabicyclo[5.4.2]tridecane
IUPAC Name: 1,7-diazabicyclo[5.4.2]tridecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.4.2]tridecane
MOLECULAR FORMULA: C11H22N2
MOLECULAR WEIGHT: 182.30578
SMILES: C1CCN2CCCCN(CC1)CC2
Structure:
CAS RN: 84904-98-3
CAS Name: 1,7-diazabicyclo[5.3.3]tridecane
OPENEYE Name: 1,7-diazabicyclo[5.3.3]tridecane
IUPAC Name: 1,7-diazabicyclo[5.3.3]tridecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.3.3]tridecane
MOLECULAR FORMULA: C11H22N2
MOLECULAR WEIGHT: 182.30578
SMILES: C1CCN2CCCN(CC1)CCC2
Structure:
CAS RN: 84904-97-2
CAS Name: 1,7-diazabicyclo[5.3.2]dodecane
OPENEYE Name: 1,7-diazabicyclo[5.3.2]dodecane
IUPAC Name: 1,7-diazabicyclo[5.3.2]dodecane
SYSTEMATIC NAME: 1,7-diazabicyclo[5.3.2]dodecane
MOLECULAR FORMULA: C10H20N2
MOLECULAR WEIGHT: 168.2792
SMILES: C1CCN2CCCN(CC1)CC2
Structure:
CAS RN: 84814-11-9
CAS Name: 1,3-ditert-butyl-2-methyl-2H-1,3,2-diazasilole
OPENEYE Name: 1,3-ditert-butyl-2-methyl-2H-1,3,2-diazasilole
IUPAC Name: 1,3-ditert-butyl-2-methyl-2H-1,3,2-diazasilole
SYSTEMATIC NAME: 1,3-ditert-butyl-2-methyl-2H-1,3,2-diazasilole
MOLECULAR FORMULA: C11H24N2Si
MOLECULAR WEIGHT: 212.40716
SMILES: CC(C)(C)N1C=CN([SiH]1C)C(C)(C)C
Structure:
CAS RN: 84814-09-5
CAS Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2-diazasilole
OPENEYE Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2-diazasilole
IUPAC Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2-diazasilole
SYSTEMATIC NAME: 1,3-ditert-butyl-2,2-dimethyl-1,3,2-diazasilole
MOLECULAR FORMULA: C12H26N2Si
MOLECULAR WEIGHT: 226.43374
SMILES: CC(C)(C)N1C=CN([Si]1(C)C)C(C)(C)C
Structure:
CAS RN: 84806-16-6
CAS Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2,4-diazasilaplumbetidine
OPENEYE Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2,4-diazasilaplumbetidine
IUPAC Name: 1,3-ditert-butyl-2,2-dimethyl-1,3,2,4-diazasilaplumbetidine
SYSTEMATIC NAME: 1,3-ditert-butyl-2,2-dimethyl-1,3,2,4-diazasilaplumbetidine
MOLECULAR FORMULA: C10H26N2PbSi
MOLECULAR WEIGHT: 409.61234
SMILES: CC(C)(C)N1[Si](N([PbH2]1)C(C)(C)C)(C)C
Structure:
CAS RN: 84615-33-8
CAS Name: cyclohexa-2,5-diene-1,4-dithione
OPENEYE Name: cyclohexa-2,5-diene-1,4-dithione
IUPAC Name: cyclohexa-2,5-diene-1,4-dithione
SYSTEMATIC NAME: cyclohexa-2,5-diene-1,4-dithione
MOLECULAR FORMULA: C6H4S2
MOLECULAR WEIGHT: 140.22596
SMILES: C1=CC(=S)C=CC1=S
Structure:
CAS RN: 84612-74-8
CAS Name: acetic acid 2,4-dimethylpentan-3-yl ester
OPENEYE Name: (1-isopropyl-2-methyl-propyl) acetate
IUPAC Name: 2,4-dimethylpentan-3-yl acetate
SYSTEMATIC NAME: 2,4-dimethylpentan-3-yl ethanoate
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CC(C)C(C(C)C)OC(=O)C
Structure:
CAS RN: 84612-71-5
CAS Name: acetic acid 4-methylhexan-3-yl ester
OPENEYE Name: (1-ethyl-2-methyl-butyl) acetate
IUPAC Name: 4-methylhexan-3-yl acetate
SYSTEMATIC NAME: 4-methylhexan-3-yl ethanoate
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CCC(C)C(CC)OC(=O)C
Structure:
CAS RN: 84509-55-7
CAS Name: 1-azabicyclo[4.4.4]tetradec-5-ene
OPENEYE Name: 1-azabicyclo[4.4.4]tetradec-5-ene
IUPAC Name: 1-azabicyclo[4.4.4]tetradec-5-ene
SYSTEMATIC NAME: 1-azabicyclo[4.4.4]tetradec-5-ene
MOLECULAR FORMULA: C13H23N
MOLECULAR WEIGHT: 193.32842
SMILES: C1CCN2CCCCC(=CCCC2)C1
Structure:
CAS RN: 84483-22-7
CAS Name: 2,6-dibromo-3-chloro-4-methylaniline
OPENEYE Name: 2,6-dibromo-3-chloro-4-methyl-aniline
IUPAC Name: 2,6-dibromo-3-chloro-4-methylaniline
SYSTEMATIC NAME: 2,6-bis(bromanyl)-3-chloranyl-4-methyl-aniline
MOLECULAR FORMULA: C7H6Br2ClN
MOLECULAR WEIGHT: 299.39024
SMILES: CC1=CC(=C(C(=C1Cl)Br)N)Br
Structure:
CAS RN: 84477-45-2
CAS Name: 2,7-ditert-butyl-4,5-dimethylthiepin
OPENEYE Name: 2,7-ditert-butyl-4,5-dimethyl-thiepine
IUPAC Name: 2,7-ditert-butyl-4,5-dimethylthiepine
SYSTEMATIC NAME: 2,7-ditert-butyl-4,5-dimethyl-thiepine
MOLECULAR FORMULA: C16H26S
MOLECULAR WEIGHT: 250.44264
SMILES: CC1=C(C=C(SC(=C1)C(C)(C)C)C(C)(C)C)C
Structure:
CAS RN: 84477-43-0
CAS Name: 2,7-ditert-butyl-4-methylthiepin
OPENEYE Name: 2,7-ditert-butyl-4-methyl-thiepine
IUPAC Name: 2,7-ditert-butyl-4-methylthiepine
SYSTEMATIC NAME: 2,7-ditert-butyl-4-methyl-thiepine
MOLECULAR FORMULA: C15H24S
MOLECULAR WEIGHT: 236.41606
SMILES: CC1=CC=C(SC(=C1)C(C)(C)C)C(C)(C)C
Structure:
CAS RN: 84451-42-3
CAS Name: 3$l^{6}-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide
OPENEYE Name: 3$l^{6}-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide
IUPAC Name: 3$l^{6}-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide
SYSTEMATIC NAME: 3$l^{6}-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide
MOLECULAR FORMULA: C6H8O2S
MOLECULAR WEIGHT: 144.19152
SMILES: C1C2C=CC2CS1(=O)=O
Structure:
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