Tuesday, October 25, 2011

http://ChemLookup.com Compounds




CAS RN: 31477-55-1
CAS Name: 1-[2-[4-[(Z)-2,3-diphenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
OPENEYE Name: 1-[2-[4-[(Z)-2,3-diphenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
IUPAC Name: 1-[2-[4-[(Z)-2,3-diphenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-[4-[(Z)-2,3-diphenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
MOLECULAR FORMULA: C27H29NO
MOLECULAR WEIGHT: 383.52526
SMILES: C1CCN(C1)CCOC2=CC=C(C=C2)/C=C(/CC3=CC=CC=C3)\C4=CC=CC=C4
Structure:

CAS RN: 31477-54-0
CAS Name: 1-[2-[4-[(Z)-3-(3-methoxyphenyl)-2-phenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
OPENEYE Name: 1-[2-[4-[(Z)-3-(3-methoxyphenyl)-2-phenyl-prop-1-enyl]phenoxy]ethyl]pyrrolidine
IUPAC Name: 1-[2-[4-[(Z)-3-(3-methoxyphenyl)-2-phenylprop-1-enyl]phenoxy]ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-[4-[(Z)-3-(3-methoxyphenyl)-2-phenyl-prop-1-enyl]phenoxy]ethyl]pyrrolidine
MOLECULAR FORMULA: C28H31NO2
MOLECULAR WEIGHT: 413.55124
SMILES: COC1=CC=CC(=C1)C/C(=C/C2=CC=C(C=C2)OCCN3CCCC3)/C4=CC=CC=C4
Structure:

CAS RN: 31432-71-0
CAS Name: N4-[7-chloro-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinolinyl]-N1,N1-diethylpentane-1,4-diamine; phosphoric acid
OPENEYE Name: N4-[7-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]-4-quinolyl]-N1,N1-diethyl-pentane-1,4-diamine; phosphoric acid
IUPAC Name: 4-N-[7-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine; phosphoric acid
SYSTEMATIC NAME: N4-[7-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinolin-4-yl]-N1,N1-diethyl-pentane-1,4-diamine; phosphoric acid
MOLECULAR FORMULA: C24H38ClN4O15P3
MOLECULAR WEIGHT: 750.950603
SMILES: CCN(CC)CCCC(C)NC1=CC(=NC2=C1C=CC(=C2)Cl)/C=C/C3=CC=C(O3)[N+](=O)[O-].OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O
Structure:

CAS RN: 31432-70-9
CAS Name: 3-[[7-chloro-2-[(1E,3E)-4-(5-nitro-2-furanyl)buta-1,3-dienyl]-4-quinolinyl]amino]-1-propanol; phosphoric acid
OPENEYE Name: 3-[[7-chloro-2-[(1E,3E)-4-(5-nitro-2-furyl)buta-1,3-dienyl]-4-quinolyl]amino]propan-1-ol; phosphoric acid
IUPAC Name: 3-[[7-chloro-2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinolin-4-yl]amino]propan-1-ol; phosphoric acid
SYSTEMATIC NAME: 3-[[7-chloranyl-2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinolin-4-yl]amino]propan-1-ol; phosphoric acid
MOLECULAR FORMULA: C20H24ClN3O12P2
MOLECULAR WEIGHT: 595.817982
SMILES: C1=CC2=C(C=C1Cl)N=C(C=C2NCCCO)/C=C/C=C/C3=CC=C(O3)[N+](=O)[O-].OP(=O)(O)O.OP(=O)(O)O
Structure:

CAS RN: 31432-69-6
CAS Name: 4,7-dichloro-2-[(1E,3E)-4-(5-nitro-2-furanyl)buta-1,3-dienyl]quinoline
OPENEYE Name: 4,7-dichloro-2-[(1E,3E)-4-(5-nitro-2-furyl)buta-1,3-dienyl]quinoline
IUPAC Name: 4,7-dichloro-2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinoline
SYSTEMATIC NAME: 4,7-bis(chloranyl)-2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinoline
MOLECULAR FORMULA: C17H10Cl2N2O3
MOLECULAR WEIGHT: 361.1789
SMILES: C1=CC2=C(C=C1Cl)N=C(C=C2Cl)/C=C/C=C/C3=CC=C(O3)[N+](=O)[O-]
Structure:

CAS RN: 31432-65-2
CAS Name: 2-[(1E,3E)-4-(5-nitro-2-furanyl)buta-1,3-dienyl]-4-quinolinecarboxylic acid
OPENEYE Name: 2-[(1E,3E)-4-(5-nitro-2-furyl)buta-1,3-dienyl]quinoline-4-carboxylic acid
IUPAC Name: 2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinoline-4-carboxylic acid
SYSTEMATIC NAME: 2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinoline-4-carboxylic acid
MOLECULAR FORMULA: C18H12N2O5
MOLECULAR WEIGHT: 336.29828
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)O
Structure:

CAS RN: 31109-21-4
CAS Name: 2-[2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-thiazolyl]acetic acid
OPENEYE Name: 2-[2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]thiazol-4-yl]acetic acid
IUPAC Name: 2-[2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1,3-thiazol-4-yl]acetic acid
SYSTEMATIC NAME: 2-[2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1,3-thiazol-4-yl]ethanoic acid
MOLECULAR FORMULA: C14H11NO4S
MOLECULAR WEIGHT: 289.30644
SMILES: C1OC2=C(O1)C=C(C=C2)/C=C/C3=NC(=CS3)CC(=O)O
Structure:

CAS RN: 30978-51-9
CAS Name: [[(Z)-3-chlorobut-2-enyl]thio]-di(propan-2-yloxy)-sulfanylidenephosphorane
OPENEYE Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-diisopropoxy-thioxo-$l^{5}-phosphane
IUPAC Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-di(propan-2-yloxy)-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: [(Z)-3-chloranylbut-2-enyl]sulfanyl-di(propan-2-yloxy)-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C10H20ClO2PS2
MOLECULAR WEIGHT: 302.821361
SMILES: CC(C)OP(=S)(OC(C)C)SC/C=C(/C)\Cl
Structure:

CAS RN: 30978-49-5
CAS Name: [[(Z)-3-chlorobut-2-enyl]thio]-diethoxy-sulfanylidenephosphorane
OPENEYE Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-diethoxy-thioxo-$l^{5}-phosphane
IUPAC Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-diethoxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: [(Z)-3-chloranylbut-2-enyl]sulfanyl-diethoxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C8H16ClO2PS2
MOLECULAR WEIGHT: 274.768201
SMILES: CCOP(=S)(OCC)SC/C=C(/C)\Cl
Structure:

CAS RN: 30978-47-3
CAS Name: [[(Z)-3-chlorobut-2-enyl]thio]-dimethoxy-sulfanylidenephosphorane
OPENEYE Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-dimethoxy-thioxo-$l^{5}-phosphane
IUPAC Name: [(Z)-3-chlorobut-2-enyl]sulfanyl-dimethoxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: [(Z)-3-chloranylbut-2-enyl]sulfanyl-dimethoxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C6H12ClO2PS2
MOLECULAR WEIGHT: 246.715041
SMILES: C/C(=C/CSP(=S)(OC)OC)/Cl
Structure:

CAS RN: 30454-12-7
CAS Name: (E)-2-butenedioic acid; 2-(2-chloro-11-methyl-5-benzo[b][1]benzazepinyl)-N-methylethanamine
OPENEYE Name: 2-(2-chloro-11-methyl-benzo[b][1]benzazepin-5-yl)-N-methyl-ethanamine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-(2-chloro-11-methylbenzo[b][1]benzazepin-5-yl)-N-methylethanamine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-(2-chloranyl-11-methyl-benzo[b][1]benzazepin-5-yl)-N-methyl-ethanamine
MOLECULAR FORMULA: C22H23ClN2O4
MOLECULAR WEIGHT: 414.88202
SMILES: CNCCC1=CC2=CC=CC=C2N(C3=C1C=CC(=C3)Cl)C.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 30319-78-9
CAS Name: (E)-2-butenedioic acid; propanoic acid 3-[4-[3-(methylthio)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]-1-piperazinyl]propyl ester
OPENEYE Name: fumaric acid; 3-[4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl propanoate
IUPAC Name: (E)-but-2-enedioic acid; 3-[4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl propanoate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl propanoate
MOLECULAR FORMULA: C33H40N2O10S2
MOLECULAR WEIGHT: 688.8081
SMILES: CCC(=O)OCCCN1CCN(CC1)C2C3=C(SC4=CC=CC=C4C2)C=CC(=C3)SC.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 30319-66-5
CAS Name: (E)-2-butenedioic acid; 4-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]-1-butanol
OPENEYE Name: 4-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]butan-1-ol; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 4-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]butan-1-ol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 4-[4-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]butan-1-ol
MOLECULAR FORMULA: C30H35ClN2O9S
MOLECULAR WEIGHT: 635.1249
SMILES: C1N(CCN(C1)C2C3=C(SC4=CC=CC=C4C2)C=CC(=C3)Cl)CCCCO.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 30319-65-4
CAS Name: (E)-2-butenedioic acid; 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]-1-propanol
OPENEYE Name: 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[4-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol
MOLECULAR FORMULA: C29H33ClN2O9S
MOLECULAR WEIGHT: 621.09832
SMILES: C1N(CCN(C1)C2C3=C(SC4=CC=CC=C4C2)C=CC(=C3)Cl)CCCO.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 30311-48-9
CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzothiazole
OPENEYE Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]-4,5,6,7-tetrahydro-1,3-benzothiazole
IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzothiazole
SYSTEMATIC NAME: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzothiazole
MOLECULAR FORMULA: C13H12N2O3S
MOLECULAR WEIGHT: 276.31098
SMILES: C1CCC2=C(C1)N=C(S2)/C=C/C3=CC=C(O3)[N+](=O)[O-]
Structure:

CAS RN: 30294-43-0
CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzoxazole
OPENEYE Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]-4,5,6,7-tetrahydro-1,3-benzoxazole
IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzoxazole
SYSTEMATIC NAME: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4,5,6,7-tetrahydro-1,3-benzoxazole
MOLECULAR FORMULA: C13H12N2O4
MOLECULAR WEIGHT: 260.24538
SMILES: C1CCC2=C(C1)N=C(O2)/C=C/C3=CC=C(O3)[N+](=O)[O-]
Structure:

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