Tuesday, October 25, 2011

http://ChemLookup.com Compounds




CAS RN: 21964-23-8
CAS Name: (Z)-3-bromo-2-pentene
OPENEYE Name: (Z)-3-bromopent-2-ene
IUPAC Name: (Z)-3-bromopent-2-ene
SYSTEMATIC NAME: (Z)-3-bromanylpent-2-ene
MOLECULAR FORMULA: C5H9Br
MOLECULAR WEIGHT: 149.02896
SMILES: CC/C(=C/C)/Br
Structure:

CAS RN: 21957-74-4
CAS Name: (E)-2-butenedioic acid; N-(5-chloro-2-methylphenyl)-N-[3-(4-morpholinyl)propyl]-4-pyridinamine
OPENEYE Name: N-(5-chloro-2-methyl-phenyl)-N-(3-morpholinopropyl)pyridin-4-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; N-(5-chloro-2-methylphenyl)-N-(3-morpholin-4-ylpropyl)pyridin-4-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; N-(5-chloranyl-2-methyl-phenyl)-N-(3-morpholin-4-ylpropyl)pyridin-4-amine
MOLECULAR FORMULA: C27H32ClN3O9
MOLECULAR WEIGHT: 578.01068
SMILES: CC1=C(C=C(C=C1)Cl)N(C2=CC=NC=C2)CCCN3CCOCC3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21889-12-3
CAS Name: (1E,3E)-1,3-bis[[4-(dimethylamino)phenyl]methylidene]-2-indenone
OPENEYE Name: (1E,3E)-1,3-bis[[4-(dimethylamino)phenyl]methylene]indan-2-one
IUPAC Name: (1E,3E)-1,3-bis[[4-(dimethylamino)phenyl]methylidene]inden-2-one
SYSTEMATIC NAME: (1E,3E)-1,3-bis[[4-(dimethylamino)phenyl]methylidene]inden-2-one
MOLECULAR FORMULA: C27H26N2O
MOLECULAR WEIGHT: 394.50814
SMILES: CN(C1=CC=C(C=C1)/C=C\2/C(=O)/C(=C/C3=CC=C(C=C3)N(C)C)/C4=CC=CC=C24)C
Structure:

CAS RN: 21801-27-4
CAS Name: 1-[4-[(E)-3-(2-chlorophenyl)prop-2-enyl]-1-piperazinyl]-1-butanone hydrochloride
OPENEYE Name: 1-[4-[(E)-3-(2-chlorophenyl)allyl]piperazin-1-yl]butan-1-one hydrochloride
IUPAC Name: 1-[4-[(E)-3-(2-chlorophenyl)prop-2-enyl]piperazin-1-yl]butan-1-one hydrochloride
SYSTEMATIC NAME: 1-[4-[(E)-3-(2-chlorophenyl)prop-2-enyl]piperazin-1-yl]butan-1-one hydrochloride
MOLECULAR FORMULA: C17H24Cl2N2O
MOLECULAR WEIGHT: 343.29126
SMILES: CCCC(=O)N1CCN(CC1)C/C=C/C2=CC=CC=C2Cl.Cl
Structure:

CAS RN: 21787-63-3
CAS Name: (E)-2-butenedioic acid; 4-chloro-N-(1-methyl-3-pyrrolidinyl)-N-phenylbenzamide
OPENEYE Name: 4-chloro-N-(1-methylpyrrolidin-3-yl)-N-phenyl-benzamide; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 4-chloro-N-(1-methylpyrrolidin-3-yl)-N-phenylbenzamide
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 4-chloranyl-N-(1-methylpyrrolidin-3-yl)-N-phenyl-benzamide
MOLECULAR FORMULA: C22H23ClN2O5
MOLECULAR WEIGHT: 430.88142
SMILES: CN1CCC(C1)N(C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21787-61-1
CAS Name: (E)-2-butenedioic acid; N-phenyl-N-[1-(2-phenylethyl)-3-pyrrolidinyl]propanamide
OPENEYE Name: fumaric acid; N-phenyl-N-[1-(2-phenylethyl)pyrrolidin-3-yl]propanamide
IUPAC Name: (E)-but-2-enedioic acid; N-phenyl-N-[1-(2-phenylethyl)pyrrolidin-3-yl]propanamide
SYSTEMATIC NAME: (E)-but-2-enedioic acid; N-phenyl-N-[1-(2-phenylethyl)pyrrolidin-3-yl]propanamide
MOLECULAR FORMULA: C25H30N2O5
MOLECULAR WEIGHT: 438.5161
SMILES: CCC(=O)N(C1CCN(C1)CCC2=CC=CC=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21760-61-2
CAS Name: acetic acid 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]propyl ester; (E)-2-butenedioic acid
OPENEYE Name: 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl acetate; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl acetate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[4-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propyl ethanoate
MOLECULAR FORMULA: C31H35ClN2O10S
MOLECULAR WEIGHT: 663.135
SMILES: CC(=O)OCCCN1CCN(CC1)C2C3=C(SC4=CC=CC=C4C2)C=CC(=C3)Cl.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21760-60-1
CAS Name: acetic acid 2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]ethyl ester; (E)-2-butenedioic acid
OPENEYE Name: 2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl acetate; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl acetate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-[4-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl ethanoate
MOLECULAR FORMULA: C30H33ClN2O10S
MOLECULAR WEIGHT: 649.10842
SMILES: CC(=O)OCCN1CCN(CC1)C2C3=C(SC4=CC=CC=C4C2)C=CC(=C3)Cl.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21699-88-7
CAS Name: (E)-2-butenedioic acid; 1-phenyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
OPENEYE Name: fumaric acid; 1-phenyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-phenyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-phenyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C24H28N2O4S
MOLECULAR WEIGHT: 440.55512
SMILES: C1CC(C2=CC=CC=C2SC1)N3CCN(CC3)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21699-87-6
CAS Name: (Z)-2-butenedioic acid; 1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
OPENEYE Name: maleic acid; 1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
IUPAC Name: (Z)-but-2-enedioic acid; 1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C23H30N2O8S
MOLECULAR WEIGHT: 494.5579
SMILES: CN1CCN(CC1)C2C3=CC=CC=C3SCCC2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 21699-86-5
CAS Name: (Z)-2-butenedioic acid; 4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)morpholine
OPENEYE Name: maleic acid; 4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)morpholine
IUPAC Name: (Z)-but-2-enedioic acid; 4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)morpholine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)morpholine
MOLECULAR FORMULA: C18H23NO5S
MOLECULAR WEIGHT: 365.44392
SMILES: C1CC(C2=CC=CC=C2SC1)N3CCOCC3.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 21699-85-4
CAS Name: (Z)-2-butenedioic acid; 1-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperidine
OPENEYE Name: maleic acid; 1-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperidine
IUPAC Name: (Z)-but-2-enedioic acid; 1-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperidine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperidine
MOLECULAR FORMULA: C19H25NO4S
MOLECULAR WEIGHT: 363.4711
SMILES: C1CCN(CC1)C2CCCSC3=CC=CC=C23.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 21641-60-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H24N2O3
MOLECULAR WEIGHT: 352.42686
SMILES: C/C=C\1/CN2[C@H]3CC1C4([C@@H]2CC5([C@@H]4O)C3NC6=CC=CC=C56)C(=O)OC
Structure:

CAS RN: 21395-86-8
CAS Name: (Z)-3-dimethoxyphosphinothioyloxy-2-pentenedioic acid dimethyl ester
OPENEYE Name: dimethyl (Z)-3-dimethoxyphosphinothioyloxypent-2-enedioate
IUPAC Name: dimethyl (Z)-3-dimethoxyphosphinothioyloxypent-2-enedioate
SYSTEMATIC NAME: dimethyl (Z)-3-dimethoxyphosphinothioyloxypent-2-enedioate
MOLECULAR FORMULA: C9H15O7PS
MOLECULAR WEIGHT: 298.249961
SMILES: COC(=O)C/C(=C/C(=O)OC)/OP(=S)(OC)OC
Structure:

CAS RN: 21373-58-0
CAS Name: (Z)-N4-(7-chloro-4-quinolinyl)-N1,N1-diethyl-2-pentene-1,4-diamine
OPENEYE Name: (Z)-N4-(7-chloro-4-quinolyl)-N1,N1-diethyl-pent-2-ene-1,4-diamine
IUPAC Name: (Z)-4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpent-2-ene-1,4-diamine
SYSTEMATIC NAME: (Z)-N4-(7-chloranylquinolin-4-yl)-N1,N1-diethyl-pent-2-ene-1,4-diamine
MOLECULAR FORMULA: C18H24ClN3
MOLECULAR WEIGHT: 317.85626
SMILES: CCN(CC)C/C=C\C(C)NC1=C2C=CC(=CC2=NC=C1)Cl
Structure:

CAS RN: 21373-57-9
CAS Name: (Z)-N-(7-chloro-4-quinolinyl)-N',N'-diethyl-2-butene-1,4-diamine
OPENEYE Name: (Z)-N-(7-chloro-4-quinolyl)-N',N'-diethyl-but-2-ene-1,4-diamine
IUPAC Name: (Z)-N-(7-chloroquinolin-4-yl)-N',N'-diethylbut-2-ene-1,4-diamine
SYSTEMATIC NAME: (Z)-N-(7-chloranylquinolin-4-yl)-N',N'-diethyl-but-2-ene-1,4-diamine
MOLECULAR FORMULA: C17H22ClN3
MOLECULAR WEIGHT: 303.82968
SMILES: CCN(CC)C/C=C\CNC1=C2C=CC(=CC2=NC=C1)Cl
Structure:

CAS RN: 21269-15-8
CAS Name: (E)-2-butenedioic acid; 3,4,5-trimethoxybenzoic acid 3-[3-(2-methoxyphenoxy)-1-pyrrolidinyl]propyl ester
OPENEYE Name: fumaric acid; 3-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]propyl 3,4,5-trimethoxybenzoate
IUPAC Name: (E)-but-2-enedioic acid; 3-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]propyl 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]propyl 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C28H35NO11
MOLECULAR WEIGHT: 561.5776
SMILES: COC1=CC=CC=C1OC2CCN(C2)CCCOC(=O)C3=CC(=C(C(=C3)OC)OC)OC.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 165108-07-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H63NO11
MOLECULAR WEIGHT: 769.96042
SMILES: C[C@H]1CC[C@]2(C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]\5[C@@]4([C@@H](C=C(/C5=N\O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O)OC)\C)O[C@@H]1C7CCCCC7
Structure:

CAS RN: 122946-42-3
CAS Name: 7-[(3S,4R,5S)-3-hexyl-6,8-dioxo-7,9-diazaspiro[4.4]nonan-4-yl]heptanoic acid
OPENEYE Name: 7-[(3S,4R,5S)-3-hexyl-6,8-dioxo-7,9-diazaspiro[4.4]nonan-4-yl]heptanoic acid
IUPAC Name: 7-[(3S,4R,5S)-3-hexyl-6,8-dioxo-7,9-diazaspiro[4.4]nonan-4-yl]heptanoic acid
SYSTEMATIC NAME: 7-[(3S,4R,5S)-3-hexyl-6,8-bis(oxidanylidene)-7,9-diazaspiro[4.4]nonan-4-yl]heptanoic acid
MOLECULAR FORMULA: C20H34N2O4
MOLECULAR WEIGHT: 366.49496
SMILES: CCCCCC[C@H]1CC[C@]2([C@@H]1CCCCCCC(=O)O)C(=O)NC(=O)N2
Structure:

CAS RN: 21074-54-4
CAS Name: 3-[4-[(E)-2-(1H-indol-3-yl)ethenyl]-1-pyridin-1-iumyl]propyl-trimethylammonium dibromide
OPENEYE Name: 3-[4-[(E)-2-(1H-indol-3-yl)vinyl]pyridin-1-ium-1-yl]propyl-trimethyl-ammonium dibromide
IUPAC Name: 3-[4-[(E)-2-(1H-indol-3-yl)ethenyl]pyridin-1-ium-1-yl]propyl-trimethylazanium dibromide
SYSTEMATIC NAME: 3-[4-[(E)-2-(1H-indol-3-yl)ethenyl]pyridin-1-ium-1-yl]propyl-trimethyl-azanium dibromide
MOLECULAR FORMULA: C21H27Br2N3
MOLECULAR WEIGHT: 481.26718
SMILES: C[N+](C)(C)CCC[N+]1=CC=C(C=C1)/C=C/C2=CNC3=CC=CC=C32.[Br-].[Br-]
Structure:

CAS RN: 21074-53-3
CAS Name: trimethyl-[3-[4-[(E)-2-(1-naphthalenyl)ethenyl]-1-pyridin-1-iumyl]propyl]ammonium dibromide
OPENEYE Name: trimethyl-[3-[4-[(E)-2-(1-naphthyl)vinyl]pyridin-1-ium-1-yl]propyl]ammonium dibromide
IUPAC Name: trimethyl-[3-[4-[(E)-2-naphthalen-1-ylethenyl]pyridin-1-ium-1-yl]propyl]azanium dibromide
SYSTEMATIC NAME: trimethyl-[3-[4-[(E)-2-naphthalen-1-ylethenyl]pyridin-1-ium-1-yl]propyl]azanium dibromide
MOLECULAR FORMULA: C23H28Br2N2
MOLECULAR WEIGHT: 492.28982
SMILES: C[N+](C)(C)CCC[N+]1=CC=C(C=C1)/C=C/C2=CC=CC3=CC=CC=C32.[Br-].[Br-]
Structure:

CAS RN: 21026-25-5
CAS Name: (E)-2-butenedioic acid; 4,5-dimethyl-2-[4-(3,3,3-triphenylpropyl)-1-piperazinyl]pyrimidine
OPENEYE Name: 4,5-dimethyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 4,5-dimethyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 4,5-dimethyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidine
MOLECULAR FORMULA: C35H38N4O4
MOLECULAR WEIGHT: 578.70062
SMILES: CC1=CN=C(N=C1C)N2CCN(CC2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 21024-64-6
CAS Name: (Z)-2-butenedioic acid; N-[1-(phenylmethyl)cyclopentyl]-3-pyridinecarboxamide
OPENEYE Name: N-(1-benzylcyclopentyl)pyridine-3-carboxamide; maleic acid
IUPAC Name: N-(1-benzylcyclopentyl)pyridine-3-carboxamide; (Z)-but-2-enedioic acid
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; N-[1-(phenylmethyl)cyclopentyl]pyridine-3-carboxamide
MOLECULAR FORMULA: C22H24N2O5
MOLECULAR WEIGHT: 396.43636
SMILES: C1CCC(C1)(CC2=CC=CC=C2)NC(=O)C3=CN=CC=C3.C(=C\C(=O)O)\C(=O)O
Structure:

CAS RN: 21015-15-6
CAS Name: (E)-3-phenyl-N-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]-2-propenamide
OPENEYE Name: (E)-N-[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-phenyl-prop-2-enamide
IUPAC Name: (E)-3-phenyl-N-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-phenyl-N-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C19H18F3NO
MOLECULAR WEIGHT: 333.34753
SMILES: CC(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)/C=C/C2=CC=CC=C2
Structure:

CAS RN: 20902-78-7
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-(3-phenyl-1H-inden-1-yl)piperidine
OPENEYE Name: fumaric acid; 1-methyl-4-(3-phenyl-1H-inden-1-yl)piperidine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1H-inden-1-yl)piperidine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1H-inden-1-yl)piperidine
MOLECULAR FORMULA: C25H27NO4
MOLECULAR WEIGHT: 405.48618
SMILES: CN1CCC(CC1)C2C=C(C3=CC=CC=C23)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 20902-77-6
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-(3-phenyl-1H-inden-2-yl)piperidine
OPENEYE Name: fumaric acid; 1-methyl-4-(3-phenyl-1H-inden-2-yl)piperidine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1H-inden-2-yl)piperidine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(3-phenyl-1H-inden-2-yl)piperidine
MOLECULAR FORMULA: C25H27NO4
MOLECULAR WEIGHT: 405.48618
SMILES: CN1CCC(CC1)C2=C(C3=CC=CC=C3C2)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 20902-76-5
CAS Name: (E)-2-butenedioic acid; 4-(1H-inden-2-yl)-1-methylpiperidine
OPENEYE Name: fumaric acid; 4-(1H-inden-2-yl)-1-methyl-piperidine
IUPAC Name: (E)-but-2-enedioic acid; 4-(1H-inden-2-yl)-1-methylpiperidine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 4-(1H-inden-2-yl)-1-methyl-piperidine
MOLECULAR FORMULA: C19H23NO4
MOLECULAR WEIGHT: 329.39022
SMILES: CN1CCC(CC1)C2=CC3=CC=CC=C3C2.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 20902-75-4
CAS Name: (E)-2-butenedioic acid; 3-(4-piperidinyl)-2,3-dihydro-1H-inden-1-ol
OPENEYE Name: fumaric acid; 3-(4-piperidyl)indan-1-ol
IUPAC Name: (E)-but-2-enedioic acid; 3-piperidin-4-yl-2,3-dihydro-1H-inden-1-ol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-piperidin-4-yl-2,3-dihydro-1H-inden-1-ol
MOLECULAR FORMULA: C18H23NO5
MOLECULAR WEIGHT: 333.37892
SMILES: C1CNCCC1C2CC(C3=CC=CC=C23)O.C(=C/C(=O)O)\C(=O)O
Structure:

CAS RN: 20902-73-2
CAS Name: (E)-2-butenedioic acid; 3-(1-methyl-4-piperidinyl)-2,3-dihydro-1H-inden-1-ol
OPENEYE Name: fumaric acid; 3-(1-methyl-4-piperidyl)indan-1-ol
IUPAC Name: (E)-but-2-enedioic acid; 3-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-inden-1-ol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 3-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-inden-1-ol
MOLECULAR FORMULA: C34H46N2O6
MOLECULAR WEIGHT: 578.73884
SMILES: CN1CCC(CC1)C2CC(C3=CC=CC=C23)O.CN1CCC(CC1)C2CC(C3=CC=CC=C23)O.C(=C/C(=O)O)\C(=O)O
Structure:

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