CAS RN: 16562-21-3
CAS Name: (E)-2-butenedioic acid; 1-phenyl-N-(3-pyridinylmethyl)-2-propanamine
OPENEYE Name: fumaric acid; 1-phenyl-N-(3-pyridylmethyl)propan-2-amine
IUPAC Name: (E)-but-2-enedioic acid; 1-phenyl-N-(pyridin-3-ylmethyl)propan-2-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-phenyl-N-(pyridin-3-ylmethyl)propan-2-amine
MOLECULAR FORMULA: C19H22N2O4
MOLECULAR WEIGHT: 342.38898
SMILES: CC(CC1=CC=CC=C1)NCC2=CN=CC=C2.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16286-09-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C41H54N2O13
MOLECULAR WEIGHT: 782.87306
SMILES: CC1/C=C/C=C(/C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C(=C2N5CCOCC5)O)O)\C
Structure:
CAS RN: 16233-60-6
CAS Name: (E)-2-butenedioic acid; 1-(4,5-dihydrothieno[2,3-b][1]benzothiepin-4-yl)-4-methylpiperazine
OPENEYE Name: 1-(4,5-dihydrothieno[2,3-b][1]benzothiepin-4-yl)-4-methyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(4,5-dihydrothieno[2,3-b][1]benzothiepin-4-yl)-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(4,5-dihydrothieno[2,3-b][1]benzothiepin-4-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C21H24N2O4S2
MOLECULAR WEIGHT: 432.55626
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=CS4.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16220-43-2
CAS Name: (3E)-3-(4,4-dioxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: (3E)-3-(4,4-dioxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: (3E)-3-(4,4-dioxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: (3E)-3-[4,4-bis(oxidanylidene)-5H-thieno[2,3-c][2]benzothiepin-10-ylidene]-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C17H20ClNO2S2
MOLECULAR WEIGHT: 369.9292
SMILES: CN(C)CC/C=C\1/C2=C(SC=C2)S(=O)(=O)CC3=CC=CC=C31.Cl
Structure:
CAS RN: 153049-45-7
CAS Name: (E)-2-butenedioic acid; (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)-1-propanamine
OPENEYE Name: (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(4-oxidanylidene-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine
MOLECULAR FORMULA: C21H23NO5S2
MOLECULAR WEIGHT: 433.54102
SMILES: CN(C)CC/C=C\1/C2=C(SC=C2)S(=O)CC3=CC=CC=C31.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16220-41-0
CAS Name: (E)-2-butenedioic acid; (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)-1-propanamine
OPENEYE Name: (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(4-oxo-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(4-oxidanylidene-5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine
MOLECULAR FORMULA: C21H23NO5S2
MOLECULAR WEIGHT: 433.54102
SMILES: CN(C)CC/C=C\1/C2=C(SC=C2)S(=O)CC3=CC=CC=C31.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16219-05-9
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-[2-(trifluoromethyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-[2-(trifluoromethyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-[2-(trifluoromethyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-[2-(trifluoromethyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
MOLECULAR FORMULA: C24H25F3N2O4S
MOLECULAR WEIGHT: 494.52651
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=CC(=C4)C(F)(F)F.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16174-79-1
CAS Name: (E)-2-butenedioic acid; 1-(3-tert-butyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
OPENEYE Name: 1-(3-tert-butyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(3-tert-butyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(3-tert-butyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C31H38N2O8S
MOLECULAR WEIGHT: 598.70702
SMILES: CC(C1=CC2=C(SC3=CC=CC=C3CC2N4CCN(CC4)C)C=C1)(C)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16174-71-3
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C28H32N2O8S
MOLECULAR WEIGHT: 556.62728
SMILES: CC1=CC2=C(SC3=CC=CC=C3CC2N4CCN(CC4)C)C=C1.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16136-23-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H30N2O5
MOLECULAR WEIGHT: 474.5482
SMILES: C1CC2C(CCC1N2CC#N)OC3C4=CC=CC=C4CCC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 16034-99-4
CAS Name: 1-[(E)-3-bromoprop-1-enyl]-4-methoxybenzene
OPENEYE Name: 1-[(E)-3-bromoprop-1-enyl]-4-methoxy-benzene
IUPAC Name: 1-[(E)-3-bromoprop-1-enyl]-4-methoxybenzene
SYSTEMATIC NAME: 1-[(E)-3-bromanylprop-1-enyl]-4-methoxy-benzene
MOLECULAR FORMULA: C10H11BrO
MOLECULAR WEIGHT: 227.09774
SMILES: COC1=CC=C(C=C1)/C=C/CBr
Structure:
CAS RN: 15931-06-3
CAS Name: (E)-2-butenedioic acid; (3E)-N,N-dimethyl-3-(2-pentyl-9-thioxanthenylidene)-1-propanamine
OPENEYE Name: (3E)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; (3E)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine
MOLECULAR FORMULA: C27H33NO4S
MOLECULAR WEIGHT: 467.62022
SMILES: CCCCCC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C\CCN(C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 15931-04-1
CAS Name: (E)-2-butenedioic acid; (3Z)-N,N-dimethyl-3-(2-pentyl-9-thioxanthenylidene)-1-propanamine
OPENEYE Name: (3Z)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; (3Z)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; (3Z)-N,N-dimethyl-3-(2-pentylthioxanthen-9-ylidene)propan-1-amine
MOLECULAR FORMULA: C27H33NO4S
MOLECULAR WEIGHT: 467.62022
SMILES: CCCCCC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 15931-03-0
CAS Name: butanedioic acid; (3E)-3-(2-tert-butyl-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine
OPENEYE Name: (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; succinic acid
IUPAC Name: butanedioic acid; (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: butanedioic acid; (3E)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C26H33NO4S
MOLECULAR WEIGHT: 455.60952
SMILES: CC(C)(C)C1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C\CCN(C)C.C(CC(=O)O)C(=O)O
Structure:
CAS RN: 15931-02-9
CAS Name: butanedioic acid; (3Z)-3-(2-tert-butyl-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine
OPENEYE Name: (3Z)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine; succinic acid
IUPAC Name: butanedioic acid; (3Z)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: butanedioic acid; (3Z)-3-(2-tert-butylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C26H33NO4S
MOLECULAR WEIGHT: 455.60952
SMILES: CC(C)(C)C1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.C(CC(=O)O)C(=O)O
Structure:
CAS RN: 15931-01-8
CAS Name: (3Z)-N,N-dimethyl-3-[2-(2-methylpropyl)-9-thioxanthenylidene]-1-propanamine hydrochloride
OPENEYE Name: (3Z)-3-(2-isobutylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: (3Z)-N,N-dimethyl-3-[2-(2-methylpropyl)thioxanthen-9-ylidene]propan-1-amine hydrochloride
SYSTEMATIC NAME: (3Z)-N,N-dimethyl-3-[2-(2-methylpropyl)thioxanthen-9-ylidene]propan-1-amine hydrochloride
MOLECULAR FORMULA: C22H28ClNS
MOLECULAR WEIGHT: 373.98242
SMILES: CC(C)CC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.Cl
Structure:
CAS RN: 15931-00-7
CAS Name: (3E)-N,N-dimethyl-3-(2-propan-2-yl-9-thioxanthenylidene)-1-propanamine hydrochloride
OPENEYE Name: (3E)-3-(2-isopropylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: (3E)-N,N-dimethyl-3-(2-propan-2-ylthioxanthen-9-ylidene)propan-1-amine hydrochloride
SYSTEMATIC NAME: (3E)-N,N-dimethyl-3-(2-propan-2-ylthioxanthen-9-ylidene)propan-1-amine hydrochloride
MOLECULAR FORMULA: C21H26ClNS
MOLECULAR WEIGHT: 359.95584
SMILES: CC(C)C1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C\CCN(C)C.Cl
Structure:
CAS RN: 15930-99-1
CAS Name: (3Z)-N,N-dimethyl-3-(2-propan-2-yl-9-thioxanthenylidene)-1-propanamine hydrochloride
OPENEYE Name: (3Z)-3-(2-isopropylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: (3Z)-N,N-dimethyl-3-(2-propan-2-ylthioxanthen-9-ylidene)propan-1-amine hydrochloride
SYSTEMATIC NAME: (3Z)-N,N-dimethyl-3-(2-propan-2-ylthioxanthen-9-ylidene)propan-1-amine hydrochloride
MOLECULAR FORMULA: C21H26ClNS
MOLECULAR WEIGHT: 359.95584
SMILES: CC(C)C1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.Cl
Structure:
CAS RN: 15930-98-0
CAS Name: (3Z)-3-(2-ethyl-9-thioxanthenylidene)-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: (3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: (3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: (3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C20H24ClNS
MOLECULAR WEIGHT: 345.92926
SMILES: CCC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.Cl
Structure:
CAS RN: 15930-96-8
CAS Name: (3E)-N,N-dimethyl-3-(2-methyl-9-thioxanthenylidene)-1-propanamine hydrochloride
OPENEYE Name: (3E)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
IUPAC Name: (3E)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
SYSTEMATIC NAME: (3E)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
MOLECULAR FORMULA: C19H22ClNS
MOLECULAR WEIGHT: 331.90268
SMILES: CC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C\CCN(C)C.Cl
Structure:
CAS RN: 15930-95-7
CAS Name: (3Z)-N,N-dimethyl-3-(2-methyl-9-thioxanthenylidene)-1-propanamine hydrochloride
OPENEYE Name: (3Z)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
IUPAC Name: (3Z)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
SYSTEMATIC NAME: (3Z)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine hydrochloride
MOLECULAR FORMULA: C19H22ClNS
MOLECULAR WEIGHT: 331.90268
SMILES: CC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.Cl
Structure:
CAS RN: 15764-77-9
CAS Name: (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxo-1-cyclohex-2-enyl)-3-methylpenta-2,4-dienoic acid ethyl ester
OPENEYE Name: ethyl (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl)-3-methyl-penta-2,4-dienoate
IUPAC Name: ethyl (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoate
SYSTEMATIC NAME: ethyl (2Z,4E)-3-methyl-5-(2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl)penta-2,4-dienoate
MOLECULAR FORMULA: C17H24O4
MOLECULAR WEIGHT: 292.37006
SMILES: CCOC(=O)/C=C(/C)\C=C\C1(C(=CC(=O)CC1(C)C)C)O
Structure:
CAS RN: 15676-58-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H29NO5
MOLECULAR WEIGHT: 423.50146
SMILES: CN1CCCC(C1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 15624-30-3
CAS Name: 2-[4-[(Z)-2-[4-[2-(diethylamino)ethoxy]phenyl]prop-1-enyl]phenoxy]-N,N-diethylethanamine dihydrochloride
OPENEYE Name: 2-[4-[(Z)-2-[4-[2-(diethylamino)ethoxy]phenyl]prop-1-enyl]phenoxy]-N,N-diethyl-ethanamine dihydrochloride
IUPAC Name: 2-[4-[(Z)-2-[4-[2-(diethylamino)ethoxy]phenyl]prop-1-enyl]phenoxy]-N,N-diethylethanamine dihydrochloride
SYSTEMATIC NAME: 2-[4-[(Z)-2-[4-[2-(diethylamino)ethoxy]phenyl]prop-1-enyl]phenoxy]-N,N-diethyl-ethanamine dihydrochloride
MOLECULAR FORMULA: C27H42Cl2N2O2
MOLECULAR WEIGHT: 497.54058
SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C=C(/C)\C2=CC=C(C=C2)OCCN(CC)CC.Cl.Cl
Structure:
CAS RN: 15624-29-0
CAS Name: N,N-diethyl-2-[4-[(E)-2-(4-phenylmethoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
OPENEYE Name: 2-[4-[(E)-2-(4-benzyloxyphenyl)prop-1-enyl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: N,N-diethyl-2-[4-[(E)-2-(4-phenylmethoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethyl-2-[4-[(E)-2-(4-phenylmethoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
MOLECULAR FORMULA: C28H34ClNO2
MOLECULAR WEIGHT: 452.02806
SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C=C(\C)/C2=CC=C(C=C2)OCC3=CC=CC=C3.Cl
Structure:
CAS RN: 15624-28-9
CAS Name: N,N-diethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]phenoxy]ethanamine hydrochloride
OPENEYE Name: 2-[4-[(E)-2-(4-benzyloxyphenyl)-1-methyl-vinyl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: N,N-diethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]phenoxy]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethyl-2-[4-[(E)-1-(4-phenylmethoxyphenyl)prop-1-en-2-yl]phenoxy]ethanamine hydrochloride
MOLECULAR FORMULA: C28H34ClNO2
MOLECULAR WEIGHT: 452.02806
SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)OCC3=CC=CC=C3)/C.Cl
Structure:
CAS RN: 15624-27-8
CAS Name: N,N-diethyl-2-[4-[(E)-2-(4-methoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
OPENEYE Name: N,N-diethyl-2-[4-[(E)-2-(4-methoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
IUPAC Name: N,N-diethyl-2-[4-[(E)-2-(4-methoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethyl-2-[4-[(E)-2-(4-methoxyphenyl)prop-1-enyl]phenoxy]ethanamine hydrochloride
MOLECULAR FORMULA: C22H30ClNO2
MOLECULAR WEIGHT: 375.9321
SMILES: CCN(CC)CCOC1=CC=C(C=C1)/C=C(\C)/C2=CC=C(C=C2)OC.Cl
Structure:
CAS RN: 366017-09-6
CAS Name: 4-[[4-[4-(1-triazolyl)butyl]phenoxy]methyl]-2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]oxazole
OPENEYE Name: 4-[[4-[4-(triazol-1-yl)butyl]phenoxy]methyl]-2-[(E)-2-[4-(trifluoromethyl)phenyl]vinyl]oxazole
IUPAC Name: 4-[[4-[4-(triazol-1-yl)butyl]phenoxy]methyl]-2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-1,3-oxazole
SYSTEMATIC NAME: 4-[[4-[4-(1,2,3-triazol-1-yl)butyl]phenoxy]methyl]-2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-1,3-oxazole
MOLECULAR FORMULA: C25H23F3N4O2
MOLECULAR WEIGHT: 468.47093
SMILES: C1=CC(=CC=C1CCCCN2C=CN=N2)OCC3=COC(=N3)/C=C/C4=CC=C(C=C4)C(F)(F)F
Structure:
CAS RN: 117423-74-2
CAS Name: 3-[[3-(2-carboxyethyl)-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]-oxomethyl]benzoic acid
OPENEYE Name: 3-[3-(2-carboxyethyl)-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid
IUPAC Name: 3-[3-(2-carboxyethyl)-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid
SYSTEMATIC NAME: 3-[3-(3-hydroxy-3-oxopropyl)-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]carbonylbenzoic acid
MOLECULAR FORMULA: C30H30O7
MOLECULAR WEIGHT: 502.555
SMILES: COC1=CC=C(C=C1)/C=C/CCCCOC2=C(C=C(C=C2)C(=O)C3=CC(=CC=C3)C(=O)O)CCC(=O)O
Structure:
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