CAS RN: 42460-67-3
CAS Name: 10-(phenylmethyl)-3,7-bis(2,4,4-trimethylpentan-2-yl)phenothiazine
OPENEYE Name: 10-benzyl-3,7-bis(1,1,3,3-tetramethylbutyl)phenothiazine
IUPAC Name: 10-benzyl-3,7-bis(2,4,4-trimethylpentan-2-yl)phenothiazine
SYSTEMATIC NAME: 10-(phenylmethyl)-3,7-bis(2,4,4-trimethylpentan-2-yl)phenothiazine
MOLECULAR FORMULA: C35H47NS
MOLECULAR WEIGHT: 513.81938
SMILES: CC(C)(C)CC(C)(C)C1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)C(C)(C)CC(C)(C)C)CC4=CC=CC=C4
Structure:
CAS RN: 42450-33-9
CAS Name: 4,5-dichloro-N2-methylbenzene-1,2-diamine
OPENEYE Name: 4,5-dichloro-N2-methyl-benzene-1,2-diamine
IUPAC Name: 4,5-dichloro-2-N-methylbenzene-1,2-diamine
SYSTEMATIC NAME: 4,5-bis(chloranyl)-N2-methyl-benzene-1,2-diamine
MOLECULAR FORMULA: C7H8Cl2N2
MOLECULAR WEIGHT: 191.05782
SMILES: CNC1=CC(=C(C=C1N)Cl)Cl
Structure:
CAS RN: 42435-97-2
CAS Name: 1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinone
OPENEYE Name: 1-methyl-5-(4-methylbenzoyl)pyrrolidin-2-one
IUPAC Name: 1-methyl-5-(4-methylbenzoyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-methyl-5-(4-methylphenyl)carbonyl-pyrrolidin-2-one
MOLECULAR FORMULA: C13H15NO2
MOLECULAR WEIGHT: 217.2637
SMILES: CC1=CC=C(C=C1)C(=O)C2CCC(=O)N2C
Structure:
CAS RN: 42434-89-9
CAS Name: 7-bromo-3-phenylbenzofuran
OPENEYE Name: 7-bromo-3-phenyl-benzofuran
IUPAC Name: 7-bromo-3-phenyl-1-benzofuran
SYSTEMATIC NAME: 7-bromanyl-3-phenyl-1-benzofuran
MOLECULAR FORMULA: C14H9BrO
MOLECULAR WEIGHT: 273.12466
SMILES: C1=CC=C(C=C1)C2=COC3=C2C=CC=C3Br
Structure:
CAS RN: 42434-88-8
CAS Name: 2-(2-bromophenoxy)-1-phenylethanone
OPENEYE Name: 2-(2-bromophenoxy)-1-phenyl-ethanone
IUPAC Name: 2-(2-bromophenoxy)-1-phenylethanone
SYSTEMATIC NAME: 2-(2-bromanylphenoxy)-1-phenyl-ethanone
MOLECULAR FORMULA: C14H11BrO2
MOLECULAR WEIGHT: 291.13994
SMILES: C1=CC=C(C=C1)C(=O)COC2=CC=CC=C2Br
Structure:
CAS RN: 42365-45-7
CAS Name: (2-iodophenyl)methanamine hydrochloride
OPENEYE Name: (2-iodophenyl)methanamine hydrochloride
IUPAC Name: (2-iodophenyl)methanamine hydrochloride
SYSTEMATIC NAME: (2-iodanylphenyl)methanamine hydrochloride
MOLECULAR FORMULA: C7H9ClIN
MOLECULAR WEIGHT: 269.51053
SMILES: C1=CC=C(C(=C1)CN)I.Cl
Structure:
CAS RN: 42347-74-0
CAS Name: 2-ethyl-3-methylpentanal
OPENEYE Name: 2-ethyl-3-methyl-pentanal
IUPAC Name: 2-ethyl-3-methylpentanal
SYSTEMATIC NAME: 2-ethyl-3-methyl-pentanal
MOLECULAR FORMULA: C8H16O
MOLECULAR WEIGHT: 128.21204
SMILES: CCC(C)C(CC)C=O
Structure:
CAS RN: 42313-44-0
CAS Name: N-[2-(bromomethyl)-3-chlorophenyl]benzamide
OPENEYE Name: N-[2-(bromomethyl)-3-chloro-phenyl]benzamide
IUPAC Name: N-[2-(bromomethyl)-3-chlorophenyl]benzamide
SYSTEMATIC NAME: N-[2-(bromomethyl)-3-chloranyl-phenyl]benzamide
MOLECULAR FORMULA: C14H11BrClNO
MOLECULAR WEIGHT: 324.60024
SMILES: C1=CC=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)CBr
Structure:
CAS RN: 42275-79-6
CAS Name: 2,2-dichloro-N-ethylacetamide
OPENEYE Name: 2,2-dichloro-N-ethyl-acetamide
IUPAC Name: 2,2-dichloro-N-ethylacetamide
SYSTEMATIC NAME: 2,2-bis(chloranyl)-N-ethyl-ethanamide
MOLECULAR FORMULA: C4H7Cl2NO
MOLECULAR WEIGHT: 156.01048
SMILES: CCNC(=O)C(Cl)Cl
Structure:
CAS RN: 42242-69-3
CAS Name: 3-[3-(tert-butylamino)-2-hydroxypropoxy]-4-chlorobenzoic acid
OPENEYE Name: 3-[3-(tert-butylamino)-2-hydroxy-propoxy]-4-chloro-benzoic acid
IUPAC Name: 3-[3-(tert-butylamino)-2-hydroxypropoxy]-4-chlorobenzoic acid
SYSTEMATIC NAME: 3-[3-(tert-butylamino)-2-oxidanyl-propoxy]-4-chloranyl-benzoic acid
MOLECULAR FORMULA: C14H20ClNO4
MOLECULAR WEIGHT: 301.7659
SMILES: CC(C)(C)NCC(COC1=C(C=CC(=C1)C(=O)O)Cl)O
Structure:
CAS RN: 42234-10-6
CAS Name: dodecanedioic acid didocosyl ester
OPENEYE Name: didocosyl dodecanedioate
IUPAC Name: didocosyl dodecanedioate
SYSTEMATIC NAME: didocosyl dodecanedioate
MOLECULAR FORMULA: C56H110O4
MOLECULAR WEIGHT: 847.4702
SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCCCCCC
Structure:
CAS RN: 42233-97-6
CAS Name: dodecanedioic acid dioctyl ester
OPENEYE Name: dioctyl dodecanedioate
IUPAC Name: dioctyl dodecanedioate
SYSTEMATIC NAME: dioctyl dodecanedioate
MOLECULAR FORMULA: C28H54O4
MOLECULAR WEIGHT: 454.72596
SMILES: CCCCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCCCC
Structure:
CAS RN: 42233-75-0
CAS Name: decanedioic acid didocosyl ester
OPENEYE Name: didocosyl decanedioate
IUPAC Name: didocosyl decanedioate
SYSTEMATIC NAME: didocosyl decanedioate
MOLECULAR FORMULA: C54H106O4
MOLECULAR WEIGHT: 819.41704
SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCCCCCC
Structure:
CAS RN: 42233-14-7
CAS Name: docosanoic acid eicosyl ester
OPENEYE Name: icosyl docosanoate
IUPAC Name: icosyl docosanoate
SYSTEMATIC NAME: icosyl docosanoate
MOLECULAR FORMULA: C42H84O2
MOLECULAR WEIGHT: 621.11516
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCCCC
Structure:
CAS RN: 42232-36-0
CAS Name: heptadecanoic acid butyl ester
OPENEYE Name: butyl heptadecanoate
IUPAC Name: butyl heptadecanoate
SYSTEMATIC NAME: butyl heptadecanoate
MOLECULAR FORMULA: C21H42O2
MOLECULAR WEIGHT: 326.55698
SMILES: CCCCCCCCCCCCCCCCC(=O)OCCCC
Structure:
CAS RN: 42231-74-3
CAS Name: dodecanoic acid nonyl ester
OPENEYE Name: nonyl dodecanoate
IUPAC Name: nonyl dodecanoate
SYSTEMATIC NAME: nonyl dodecanoate
MOLECULAR FORMULA: C21H42O2
MOLECULAR WEIGHT: 326.55698
SMILES: CCCCCCCCCCCC(=O)OCCCCCCCCC
Structure:
CAS RN: 42231-48-1
CAS Name: decanoic acid nonyl ester
OPENEYE Name: nonyl decanoate
IUPAC Name: nonyl decanoate
SYSTEMATIC NAME: nonyl decanoate
MOLECULAR FORMULA: C19H38O2
MOLECULAR WEIGHT: 298.50382
SMILES: CCCCCCCCCC(=O)OCCCCCCCCC
Structure:
CAS RN: 42231-40-3
CAS Name: octanoic acid undecyl ester
OPENEYE Name: undecyl octanoate
IUPAC Name: undecyl octanoate
SYSTEMATIC NAME: undecyl octanoate
MOLECULAR FORMULA: C19H38O2
MOLECULAR WEIGHT: 298.50382
SMILES: CCCCCCCCCCCOC(=O)CCCCCCC
Structure:
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