CAS RN: 40361-82-8
CAS Name: 1-methyl-2-nitro-5-[(E)-2-phenylethenyl]imidazole
OPENEYE Name: 1-methyl-2-nitro-5-[(E)-styryl]imidazole
IUPAC Name: 1-methyl-2-nitro-5-[(E)-2-phenylethenyl]imidazole
SYSTEMATIC NAME: 1-methyl-2-nitro-5-[(E)-2-phenylethenyl]imidazole
MOLECULAR FORMULA: C12H11N3O2
MOLECULAR WEIGHT: 229.23464
SMILES: CN1C(=CN=C1[N+](=O)[O-])/C=C/C2=CC=CC=C2
Structure:
CAS RN: 40281-15-0
CAS Name: 3-(1-azetidinyl)-1,2-diphenyl-1-propanone; (E)-2-butenedioic acid
OPENEYE Name: 3-(azetidin-1-yl)-1,2-diphenyl-propan-1-one; fumaric acid
IUPAC Name: 3-(azetidin-1-yl)-1,2-diphenylpropan-1-one; (E)-but-2-enedioic acid
SYSTEMATIC NAME: 3-(azetidin-1-yl)-1,2-diphenyl-propan-1-one; (E)-but-2-enedioic acid
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: C1CN(C1)CC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40281-12-7
CAS Name: (E)-2-butenedioic acid; 3-(methylamino)-1,2-diphenyl-1-propanone
OPENEYE Name: fumaric acid; 3-(methylamino)-1,2-diphenyl-propan-1-one
IUPAC Name: (E)-but-2-enedioic acid; 3-(methylamino)-1,2-diphenylpropan-1-one
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-(methylamino)-1,2-diphenyl-propan-1-one
MOLECULAR FORMULA: C20H21NO5
MOLECULAR WEIGHT: 355.38444
SMILES: CNCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40279-62-7
CAS Name: 5,14-dihydroxy-13-methyl-3-[[4-methyl-2-[(E)-2-phenylethenyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxaldehyde
OPENEYE Name: 5,14-dihydroxy-13-methyl-3-[[4-methyl-2-[(E)-styryl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
IUPAC Name: 5,14-dihydroxy-13-methyl-3-[[4-methyl-2-[(E)-2-phenylethenyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
SYSTEMATIC NAME: 13-methyl-3-[[4-methyl-2-[(E)-2-phenylethenyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-5,14-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
MOLECULAR FORMULA: C38H48O9
MOLECULAR WEIGHT: 648.78232
SMILES: CC1C2C(CC(O1)OC3CCC4(C5CCC6(C(CCC6(C5CCC4(C3)O)O)C7=CC(=O)OC7)C)C=O)OC(O2)/C=C/C8=CC=CC=C8
Structure:
CAS RN: 40193-47-3
CAS Name: N,N-diethyl-4-[(E)-2-phenylethenyl]aniline
OPENEYE Name: N,N-diethyl-4-[(E)-styryl]aniline
IUPAC Name: N,N-diethyl-4-[(E)-2-phenylethenyl]aniline
SYSTEMATIC NAME: N,N-diethyl-4-[(E)-2-phenylethenyl]aniline
MOLECULAR FORMULA: C18H21N
MOLECULAR WEIGHT: 251.36604
SMILES: CCN(CC)C1=CC=C(C=C1)/C=C/C2=CC=CC=C2
Structure:
CAS RN: 40028-29-3
CAS Name: (E)-2-butenedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]-1-piperazinyl]-1-propanamine
OPENEYE Name: fumaric acid; 3-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]propan-1-amine
IUPAC Name: (E)-but-2-enedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]propan-1-amine
MOLECULAR FORMULA: C35H45N3O13
MOLECULAR WEIGHT: 715.7441
SMILES: COC1=CC=C(C=C1)C(N2CCN(CC2)CCCN)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-28-2
CAS Name: (E)-2-butenedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]-1-piperazinyl]propanenitrile
OPENEYE Name: fumaric acid; 3-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]propanenitrile
IUPAC Name: (E)-but-2-enedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propanenitrile
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]propanenitrile
MOLECULAR FORMULA: C31H37N3O9
MOLECULAR WEIGHT: 595.64018
SMILES: COC1=CC=C(C=C1)C(N2CCN(CC2)CCC#N)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-26-0
CAS Name: (E)-2-butenedioic acid; 1-ethyl-4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine
OPENEYE Name: 1-ethyl-4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-ethyl-4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-ethyl-4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine
MOLECULAR FORMULA: C30H38N2O9
MOLECULAR WEIGHT: 570.63072
SMILES: CCN1CCN(CC1)C(C2=CC=C(C=C2)OC)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-25-9
CAS Name: (E)-2-butenedioic acid; 1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]-1-piperazinyl]ethanone
OPENEYE Name: fumaric acid; 1-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]ethanone
IUPAC Name: (E)-but-2-enedioic acid; 1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanone
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]ethanone
MOLECULAR FORMULA: C26H32N2O6
MOLECULAR WEIGHT: 468.54208
SMILES: CC(=O)N1CCN(CC1)C(CCC2=CC=CC=C2)C3=CC=C(C=C3)OC.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-24-8
CAS Name: (E)-2-butenedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine
OPENEYE Name: fumaric acid; 1-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine
MOLECULAR FORMULA: C24H30N2O5
MOLECULAR WEIGHT: 426.5054
SMILES: COC1=CC=C(C=C1)C(CCC2=CC=CC=C2)N3CCNCC3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-22-6
CAS Name: (E)-2-butenedioic acid; 4-[1-(4-methoxyphenyl)-3-phenylpropyl]-1-piperazinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine-1-carboxylate; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; ethyl 4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine-1-carboxylate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; ethyl 4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine-1-carboxylate
MOLECULAR FORMULA: C27H34N2O7
MOLECULAR WEIGHT: 498.56806
SMILES: CCOC(=O)N1CCN(CC1)C(CCC2=CC=CC=C2)C3=CC=C(C=C3)OC.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-21-5
CAS Name: (E)-2-butenedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-(phenylmethyl)piperazine
OPENEYE Name: 1-benzyl-4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazine; fumaric acid
IUPAC Name: 1-benzyl-4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazine; (E)-but-2-enedioic acid
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenyl-propyl]-4-(phenylmethyl)piperazine
MOLECULAR FORMULA: C35H40N2O9
MOLECULAR WEIGHT: 632.7001
SMILES: COC1=CC=C(C=C1)C(N2CCN(CC2)CC3=CC=CC=C3)CCC4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-19-1
CAS Name: (E)-2-butenedioic acid; 2-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]-1-piperazinyl]ethanol
OPENEYE Name: fumaric acid; 2-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]ethanol
IUPAC Name: (E)-but-2-enedioic acid; 2-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-[4-[1-(4-methoxyphenyl)-3-phenyl-propyl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C30H38N2O10
MOLECULAR WEIGHT: 586.63012
SMILES: COC1=CC=C(C=C1)C(N2CCN(CC2)CCO)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-18-0
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-[2-(phenylthio)-1-thiophen-2-ylethyl]piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-[2-phenylsulfanyl-1-(2-thienyl)ethyl]piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(2-phenylsulfanyl-1-thiophen-2-ylethyl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(2-phenylsulfanyl-1-thiophen-2-yl-ethyl)piperazine
MOLECULAR FORMULA: C25H30N2O8S2
MOLECULAR WEIGHT: 550.6443
SMILES: CN1CCN(CC1)C(C2=CC=CS2)CSC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-17-9
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-(3-phenyl-1-thiophen-2-ylpropyl)piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-[3-phenyl-1-(2-thienyl)propyl]piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1-thiophen-2-ylpropyl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1-thiophen-2-yl-propyl)piperazine
MOLECULAR FORMULA: C26H32N2O8S
MOLECULAR WEIGHT: 532.60588
SMILES: CN1CCN(CC1)C(C2=CC=CS2)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-15-7
CAS Name: (E)-2-butenedioic acid; 1-[1-(4-methoxyphenyl)-2-(phenylthio)ethyl]-4-methylpiperazine
OPENEYE Name: fumaric acid; 1-[1-(4-methoxyphenyl)-2-phenylsulfanyl-ethyl]-4-methyl-piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-2-phenylsulfanylethyl]-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-2-phenylsulfanyl-ethyl]-4-methyl-piperazine
MOLECULAR FORMULA: C28H34N2O9S
MOLECULAR WEIGHT: 574.64256
SMILES: CN1CCN(CC1)C(C2=CC=C(C=C2)OC)CSC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-14-6
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-[1-[4-(methylthio)phenyl]-3-phenylpropyl]piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-[1-(4-methylsulfanylphenyl)-3-phenyl-propyl]piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-[1-(4-methylsulfanylphenyl)-3-phenylpropyl]piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-[1-(4-methylsulfanylphenyl)-3-phenyl-propyl]piperazine
MOLECULAR FORMULA: C29H36N2O8S
MOLECULAR WEIGHT: 572.66974
SMILES: CN1CCN(CC1)C(C2=CC=C(C=C2)SC)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-11-3
CAS Name: (E)-2-butenedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-methylpiperazine
OPENEYE Name: fumaric acid; 1-[1-(4-methoxyphenyl)-3-phenyl-propyl]-4-methyl-piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenylpropyl]-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[1-(4-methoxyphenyl)-3-phenyl-propyl]-4-methyl-piperazine
MOLECULAR FORMULA: C29H36N2O9
MOLECULAR WEIGHT: 556.60414
SMILES: CN1CCN(CC1)C(C2=CC=C(C=C2)OC)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40028-09-9
CAS Name: (E)-2-butenedioic acid; 1-(1,3-diphenylpropyl)-4-methylpiperazine
OPENEYE Name: 1-(1,3-diphenylpropyl)-4-methyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(1,3-diphenylpropyl)-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(1,3-diphenylpropyl)-4-methyl-piperazine
MOLECULAR FORMULA: C28H34N2O8
MOLECULAR WEIGHT: 526.57816
SMILES: CN1CCN(CC1)C(C2=CC=CC=C2)CCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40019-78-1
CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-oxido-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium
OPENEYE Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-oxido-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium
IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxido-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium
SYSTEMATIC NAME: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxidanidyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium
MOLECULAR FORMULA: C13H12N2O4S
MOLECULAR WEIGHT: 292.31038
SMILES: C1CCC2=C(C1)[N+](=C(S2)/C=C/C3=CC=C(O3)[N+](=O)[O-])[O-]
Structure:
CAS RN: 40019-77-0
CAS Name: 5-butyl-4-methyl-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-oxidothiazol-3-ium
OPENEYE Name: 5-butyl-4-methyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-oxido-thiazol-3-ium
IUPAC Name: 5-butyl-4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxido-1,3-thiazol-3-ium
SYSTEMATIC NAME: 5-butyl-4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxidanidyl-1,3-thiazol-3-ium
MOLECULAR FORMULA: C14H16N2O4S
MOLECULAR WEIGHT: 308.35284
SMILES: CCCCC1=C([N+](=C(S1)/C=C/C2=CC=C(O2)[N+](=O)[O-])[O-])C
Structure:
CAS RN: 40019-76-9
CAS Name: 5-ethyl-4-methyl-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-oxidothiazol-3-ium
OPENEYE Name: 5-ethyl-4-methyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-oxido-thiazol-3-ium
IUPAC Name: 5-ethyl-4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxido-1,3-thiazol-3-ium
SYSTEMATIC NAME: 5-ethyl-4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxidanidyl-1,3-thiazol-3-ium
MOLECULAR FORMULA: C12H12N2O4S
MOLECULAR WEIGHT: 280.29968
SMILES: CCC1=C([N+](=C(S1)/C=C/C2=CC=C(O2)[N+](=O)[O-])[O-])C
Structure:
CAS RN: 40019-75-8
CAS Name: 4,5-dimethyl-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-oxidothiazol-3-ium
OPENEYE Name: 4,5-dimethyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-oxido-thiazol-3-ium
IUPAC Name: 4,5-dimethyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxido-1,3-thiazol-3-ium
SYSTEMATIC NAME: 4,5-dimethyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-oxidanidyl-1,3-thiazol-3-ium
MOLECULAR FORMULA: C11H10N2O4S
MOLECULAR WEIGHT: 266.2731
SMILES: CC1=C(SC(=[N+]1[O-])/C=C/C2=CC=C(O2)[N+](=O)[O-])C
Structure:
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