CAS RN: 427-01-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H48N4O3
MOLECULAR WEIGHT: 632.83412
SMILES: CC[C@@H]1CN2CCC34[C@@H]2C[C@@H]1[C@H]5[C@@H]3N([C@@H](OC5)[C@H]([C@@H]\6C[C@H]7C8=C(CCN7C/C6=C/C)C9=CC=CC=C9N8)C(=O)OC)C1=CC=CC=C41
Structure:
CAS RN: 304-09-6
CAS Name: 4-[(E)-2-(2-fluorophenyl)-1-phenylethenyl]phenol
OPENEYE Name: 4-[(E)-2-(2-fluorophenyl)-1-phenyl-vinyl]phenol
IUPAC Name: 4-[(E)-2-(2-fluorophenyl)-1-phenylethenyl]phenol
SYSTEMATIC NAME: 4-[(E)-2-(2-fluorophenyl)-1-phenyl-ethenyl]phenol
MOLECULAR FORMULA: C20H15FO
MOLECULAR WEIGHT: 290.330903
SMILES: C1=CC=C(C=C1)/C(=C\C2=CC=CC=C2F)/C3=CC=C(C=C3)O
Structure:
CAS RN: 299-09-2
CAS Name: 4-[(E)-2-(4-fluorophenyl)-1-phenylethenyl]phenol
OPENEYE Name: 4-[(E)-2-(4-fluorophenyl)-1-phenyl-vinyl]phenol
IUPAC Name: 4-[(E)-2-(4-fluorophenyl)-1-phenylethenyl]phenol
SYSTEMATIC NAME: 4-[(E)-2-(4-fluorophenyl)-1-phenyl-ethenyl]phenol
MOLECULAR FORMULA: C20H15FO
MOLECULAR WEIGHT: 290.330903
SMILES: C1=CC=C(C=C1)/C(=C\C2=CC=C(C=C2)F)/C3=CC=C(C=C3)O
Structure:
CAS RN: 299-08-1
CAS Name: 4-[(E)-2-(3-fluorophenyl)-1-phenylethenyl]phenol
OPENEYE Name: 4-[(E)-2-(3-fluorophenyl)-1-phenyl-vinyl]phenol
IUPAC Name: 4-[(E)-2-(3-fluorophenyl)-1-phenylethenyl]phenol
SYSTEMATIC NAME: 4-[(E)-2-(3-fluorophenyl)-1-phenyl-ethenyl]phenol
MOLECULAR FORMULA: C20H15FO
MOLECULAR WEIGHT: 290.330903
SMILES: C1=CC=C(C=C1)/C(=C\C2=CC(=CC=C2)F)/C3=CC=C(C=C3)O
Structure:
CAS RN: 5586-89-0
CAS Name: (E)-3-phenyl-2-propen-1-amine hydrochloride
OPENEYE Name: (E)-3-phenylprop-2-en-1-amine hydrochloride
IUPAC Name: (E)-3-phenylprop-2-en-1-amine hydrochloride
SYSTEMATIC NAME: (E)-3-phenylprop-2-en-1-amine hydrochloride
MOLECULAR FORMULA: C9H12ClN
MOLECULAR WEIGHT: 169.65128
SMILES: C1=CC=C(C=C1)/C=C/CN.Cl
Structure:
CAS RN: 5584-31-6
CAS Name: (4Z)-4-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)methylidene]-2,5-diphenyl-3-pyrazolone
OPENEYE Name: (4Z)-4-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)methylene]-2,5-diphenyl-pyrazol-3-one
IUPAC Name: (4Z)-4-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)methylidene]-2,5-diphenylpyrazol-3-one
SYSTEMATIC NAME: (4Z)-4-[(5-oxidanylidene-1,3-diphenyl-4H-pyrazol-4-yl)methylidene]-2,5-diphenyl-pyrazol-3-one
MOLECULAR FORMULA: C31H22N4O2
MOLECULAR WEIGHT: 482.53198
SMILES: C1=CC=C(C=C1)C2=NN(C(=O)C2/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
Structure:
CAS RN: 5526-54-5
CAS Name: (3Z)-7-methoxy-3-[(4-methoxyphenyl)methylidene]-3,4-dihydro-2H-1-benzopyran-4-one
OPENEYE Name: (3Z)-7-methoxy-3-[(4-methoxyphenyl)methylene]chroman-4-one
IUPAC Name: (3Z)-7-methoxy-3-[(4-methoxyphenyl)methylidene]chromen-4-one
SYSTEMATIC NAME: (3Z)-7-methoxy-3-[(4-methoxyphenyl)methylidene]chromen-4-one
MOLECULAR FORMULA: C18H16O4
MOLECULAR WEIGHT: 296.31724
SMILES: COC1=CC=C(C=C1)/C=C\2/COC3=C(C2=O)C=CC(=C3)OC
Structure:
CAS RN: 5518-90-1
CAS Name: (2Z)-4-acetyl-2-[(4-fluorophenyl)methylidene]-5-hydroxy-3-thiophenone
OPENEYE Name: (2Z)-4-acetyl-2-[(4-fluorophenyl)methylene]-5-hydroxy-thiophen-3-one
IUPAC Name: (2Z)-4-acetyl-2-[(4-fluorophenyl)methylidene]-5-hydroxythiophen-3-one
SYSTEMATIC NAME: (2Z)-4-ethanoyl-2-[(4-fluorophenyl)methylidene]-5-oxidanyl-thiophen-3-one
MOLECULAR FORMULA: C13H9FO3S
MOLECULAR WEIGHT: 264.272163
SMILES: CC(=O)C1=C(S/C(=C\C2=CC=C(C=C2)F)/C1=O)O
Structure:
CAS RN: 5498-60-2
CAS Name: (E)-2-butenedioic acid; 8,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 8,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-(dimethylamino)ethyl 8,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-(dimethylamino)ethyl 8,9-dimethyl-3-oxidanylidene-4-oxa-2-azaspiro[4.5]decane-2-carboxylate
MOLECULAR FORMULA: C19H30N2O8
MOLECULAR WEIGHT: 414.4501
SMILES: CC1CCC2(CC1C)CN(C(=O)O2)C(=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 5443-55-0
CAS Name: 1-[(E)-3-phenylprop-2-enyl]piperidine hydrochloride
OPENEYE Name: 1-[(E)-cinnamyl]piperidine hydrochloride
IUPAC Name: 1-[(E)-3-phenylprop-2-enyl]piperidine hydrochloride
SYSTEMATIC NAME: 1-[(E)-3-phenylprop-2-enyl]piperidine hydrochloride
MOLECULAR FORMULA: C14H20ClN
MOLECULAR WEIGHT: 237.7683
SMILES: C1CCN(CC1)C/C=C/C2=CC=CC=C2.Cl
Structure:
CAS RN: 5352-90-9
CAS Name: (Z)-2-butenedioic acid; 2-[4-[3-(2-chloro-10-phenothiazinyl)propyl]-1-piperazinyl]ethanol
OPENEYE Name: 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 2-[4-[3-(2-chloranylphenothiazin-10-yl)propyl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C29H34ClN3O9S
MOLECULAR WEIGHT: 636.11296
SMILES: C1N(CCN(C1)CCO)CCCN2C3=C(SC4=CC=CC=C24)C=CC(=C3)Cl.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 5318-20-7
CAS Name: (E)-2-butenedioic acid; 4-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperidine
OPENEYE Name: 4-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperidine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 4-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperidine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 4-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperidine
MOLECULAR FORMULA: C24H28ClNO6
MOLECULAR WEIGHT: 461.93522
SMILES: COC1=C(C=C(C=C1)CN2CCC(CC2)C3=CC=C(C=C3)Cl)OC.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 5284-80-0
CAS Name: (1E,4E)-1,5-bis(4-azidophenyl)-3-penta-1,4-dienone
OPENEYE Name: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
IUPAC Name: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
SYSTEMATIC NAME: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
MOLECULAR FORMULA: C17H12N6O
MOLECULAR WEIGHT: 316.31678
SMILES: C1=CC(=CC=C1/C=C/C(=O)/C=C/C2=CC=C(C=C2)N=[N+]=[N-])N=[N+]=[N-]
Structure:
CAS RN: 73771-52-5
CAS Name: (1E,4E)-1,5-bis(4-azidophenyl)-3-penta-1,4-dienone
OPENEYE Name: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
IUPAC Name: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
SYSTEMATIC NAME: (1E,4E)-1,5-bis(4-azidophenyl)penta-1,4-dien-3-one
MOLECULAR FORMULA: C17H12N6O
MOLECULAR WEIGHT: 316.31678
SMILES: C1=CC(=CC=C1/C=C/C(=O)/C=C/C2=CC=C(C=C2)N=[N+]=[N-])N=[N+]=[N-]
Structure:
CAS RN: 5229-38-9
CAS Name: 1-[2-[(E)-2-(1-naphthalenyl)hex-4-enoxy]ethyl]piperidine; phosphoric acid
OPENEYE Name: 1-[2-[(E)-2-(1-naphthyl)hex-4-enoxy]ethyl]piperidine; phosphoric acid
IUPAC Name: 1-[2-[(E)-2-naphthalen-1-ylhex-4-enoxy]ethyl]piperidine; phosphoric acid
SYSTEMATIC NAME: 1-[2-[(E)-2-naphthalen-1-ylhex-4-enoxy]ethyl]piperidine; phosphoric acid
MOLECULAR FORMULA: C23H34NO5P
MOLECULAR WEIGHT: 435.493521
SMILES: C/C=C/CC(COCCN1CCCCC1)C2=CC=CC3=CC=CC=C32.OP(=O)(O)O
Structure:
CAS RN: 5206-30-4
CAS Name: (E)-2-butenedioic acid; 9,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 9,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-(dimethylamino)ethyl 9,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-(dimethylamino)ethyl 9,9-dimethyl-3-oxidanylidene-4-oxa-2-azaspiro[4.5]decane-2-carboxylate
MOLECULAR FORMULA: C19H30N2O8
MOLECULAR WEIGHT: 414.4501
SMILES: CC1(CCCC2(C1)CN(C(=O)O2)C(=O)OCCN(C)C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 5130-80-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H52N4O6
MOLECULAR WEIGHT: 720.89618
SMILES: C/C=C/1\CN(C2CC3=C(C(CC1C2C(=O)OC)C4=C(C=C5C6=C(C7(CC8CC(C7N(C8)CC6)C(C)O)C(=O)OC)NC5=C4)OC)NC9=CC=CC=C39)C
Structure:
CAS RN: 5118-52-5
CAS Name: (E)-2-butenedioic acid; 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine
OPENEYE Name: 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(2-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C23H25ClN2O4S
MOLECULAR WEIGHT: 460.9736
SMILES: CN1CCN(CC1)C2CC3=C(C=C(C=C3)Cl)SC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4925-64-8
CAS Name: (Z)-2-butenedioic acid; 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinecarboxaldehyde
OPENEYE Name: 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carbaldehyde
MOLECULAR FORMULA: C23H24N2O5S
MOLECULAR WEIGHT: 440.51206
SMILES: C1CN(CCN1C=O)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4925-63-7
CAS Name: (E)-2-butenedioic acid; 2-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]ethanol
OPENEYE Name: 2-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethanol; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethanol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethanol
MOLECULAR FORMULA: C24H28N2O5S
MOLECULAR WEIGHT: 456.55452
SMILES: C1CN(CCN1CCO)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4809-81-8
CAS Name: (Z)-2-butenedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane
OPENEYE Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane
MOLECULAR FORMULA: C24H28N2O4S
MOLECULAR WEIGHT: 440.55512
SMILES: CN1CCCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
No comments:
Post a Comment