CAS RN: 7399-92-0
CAS Name: N-(6-acetylimino-1-hydroxy-4-pyrimidinyl)acetamide
OPENEYE Name: N-(6-acetylimino-1-hydroxy-pyrimidin-4-yl)acetamide
IUPAC Name: N-(6-acetylimino-1-hydroxypyrimidin-4-yl)acetamide
SYSTEMATIC NAME: N-(6-ethanoylimino-1-oxidanyl-pyrimidin-4-yl)ethanamide
MOLECULAR FORMULA: C8H10N4O3
MOLECULAR WEIGHT: 210.19
SMILES: CC(=O)NC1=CC(=NC(=O)C)N(C=N1)O
Structure:
CAS RN: 618-56-4
CAS Name: 3,5-diaminobenzoic acid chloride
OPENEYE Name: 3,5-diaminobenzoic acid chloride
IUPAC Name: 3,5-diaminobenzoic acid chloride
SYSTEMATIC NAME: 3,5-bis(azanyl)benzoic acid chloride
MOLECULAR FORMULA: C7H8ClN2O2-
MOLECULAR WEIGHT: 187.60362
SMILES: C1=C(C=C(C=C1N)N)C(=O)O.[Cl-]
Structure:
CAS RN: 51304-58-6
CAS Name: 4-phenyl-4-piperidinecarbonitrile chloride
OPENEYE Name: 4-phenylpiperidine-4-carbonitrile chloride
IUPAC Name: 4-phenylpiperidine-4-carbonitrile chloride
SYSTEMATIC NAME: 4-phenylpiperidine-4-carbonitrile chloride
MOLECULAR FORMULA: C12H14ClN2-
MOLECULAR WEIGHT: 221.70596
SMILES: C1CNCCC1(C#N)C2=CC=CC=C2.[Cl-]
Structure:
CAS RN: 10315-03-4
CAS Name: 1-(4-phenyl-4-piperidinyl)ethanone chloride
OPENEYE Name: 1-(4-phenyl-4-piperidyl)ethanone chloride
IUPAC Name: 1-(4-phenylpiperidin-4-yl)ethanone chloride
SYSTEMATIC NAME: 1-(4-phenylpiperidin-4-yl)ethanone chloride
MOLECULAR FORMULA: C13H17ClNO-
MOLECULAR WEIGHT: 238.73318
SMILES: CC(=O)C1(CCNCC1)C2=CC=CC=C2.[Cl-]
Structure:
CAS RN: 15847-64-0
CAS Name: 1-(4-phenyl-4-piperidinyl)-1-propanone chloride
OPENEYE Name: 1-(4-phenyl-4-piperidyl)propan-1-one chloride
IUPAC Name: 1-(4-phenylpiperidin-4-yl)propan-1-one chloride
SYSTEMATIC NAME: 1-(4-phenylpiperidin-4-yl)propan-1-one chloride
MOLECULAR FORMULA: C14H19ClNO-
MOLECULAR WEIGHT: 252.75976
SMILES: CCC(=O)C1(CCNCC1)C2=CC=CC=C2.[Cl-]
Structure:
CAS RN: 15847-65-1
CAS Name: 1-(4-phenyl-4-piperidinyl)-1-butanone chloride
OPENEYE Name: 1-(4-phenyl-4-piperidyl)butan-1-one chloride
IUPAC Name: 1-(4-phenylpiperidin-4-yl)butan-1-one chloride
SYSTEMATIC NAME: 1-(4-phenylpiperidin-4-yl)butan-1-one chloride
MOLECULAR FORMULA: C15H21ClNO-
MOLECULAR WEIGHT: 266.78634
SMILES: CCCC(=O)C1(CCNCC1)C2=CC=CC=C2.[Cl-]
Structure:
CAS RN: 4983-39-5
CAS Name: 4-(1-pyrrolidinyl)piperidine chloride
OPENEYE Name: 4-pyrrolidin-1-ylpiperidine chloride
IUPAC Name: 4-pyrrolidin-1-ylpiperidine chloride
SYSTEMATIC NAME: 4-pyrrolidin-1-ylpiperidine chloride
MOLECULAR FORMULA: C9H18ClN2-
MOLECULAR WEIGHT: 189.70562
SMILES: C1CCN(C1)C2CCNCC2.[Cl-]
Structure:
CAS RN: 6621-69-8
CAS Name: 1-[2-(4-nitrophenyl)-2-oxoethyl]-3-pyridin-1-iumcarboxamide bromide
OPENEYE Name: 1-[2-(4-nitrophenyl)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide bromide
IUPAC Name: 1-[2-(4-nitrophenyl)-2-oxoethyl]pyridin-1-ium-3-carboxamide bromide
SYSTEMATIC NAME: 1-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide bromide
MOLECULAR FORMULA: C14H12BrN3O4
MOLECULAR WEIGHT: 366.16678
SMILES: C1=CC(=C[N+](=C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N.[Br-]
Structure:
CAS RN: 6939-66-8
CAS Name: 2-(2,4-dimethylphenyl)ethanamine hydrochloride
OPENEYE Name: 2-(2,4-dimethylphenyl)ethanamine hydrochloride
IUPAC Name: 2-(2,4-dimethylphenyl)ethanamine hydrochloride
SYSTEMATIC NAME: 2-(2,4-dimethylphenyl)ethanamine hydrochloride
MOLECULAR FORMULA: C10H16ClN
MOLECULAR WEIGHT: 185.69374
SMILES: CC1=CC(=C(C=C1)CCN)C.Cl
Structure:
CAS RN: 3166-75-4
CAS Name: 2-(2,3,4-trimethoxyphenyl)ethanamine chloride
OPENEYE Name: 2-(2,3,4-trimethoxyphenyl)ethanamine chloride
IUPAC Name: 2-(2,3,4-trimethoxyphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(2,3,4-trimethoxyphenyl)ethanamine chloride
MOLECULAR FORMULA: C11H17ClNO3-
MOLECULAR WEIGHT: 246.71058
SMILES: COC1=C(C(=C(C=C1)CCN)OC)OC.[Cl-]
Structure:
CAS RN: 3166-84-5
CAS Name: 2-(2,3,6-trimethoxyphenyl)ethanamine chloride
OPENEYE Name: 2-(2,3,6-trimethoxyphenyl)ethanamine chloride
IUPAC Name: 2-(2,3,6-trimethoxyphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(2,3,6-trimethoxyphenyl)ethanamine chloride
MOLECULAR FORMULA: C11H17ClNO3-
MOLECULAR WEIGHT: 246.71058
SMILES: COC1=C(C(=C(C=C1)OC)OC)CCN.[Cl-]
Structure:
CAS RN: 3166-74-3
CAS Name: 2-(2,5-dimethoxyphenyl)ethanamine chloride
OPENEYE Name: 2-(2,5-dimethoxyphenyl)ethanamine chloride
IUPAC Name: 2-(2,5-dimethoxyphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(2,5-dimethoxyphenyl)ethanamine chloride
MOLECULAR FORMULA: C10H15ClNO2-
MOLECULAR WEIGHT: 216.6846
SMILES: COC1=CC(=C(C=C1)OC)CCN.[Cl-]
Structure:
CAS RN: 3167-03-1
CAS Name: 2-(2,4,5-trimethylphenyl)ethanamine chloride
OPENEYE Name: 2-(2,4,5-trimethylphenyl)ethanamine chloride
IUPAC Name: 2-(2,4,5-trimethylphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(2,4,5-trimethylphenyl)ethanamine chloride
MOLECULAR FORMULA: C11H17ClN-
MOLECULAR WEIGHT: 198.71238
SMILES: CC1=CC(=C(C=C1C)CCN)C.[Cl-]
Structure:
CAS RN: 6632-31-1
CAS Name: 2-(3,5-dimethylphenyl)ethanamine chloride
OPENEYE Name: 2-(3,5-dimethylphenyl)ethanamine chloride
IUPAC Name: 2-(3,5-dimethylphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(3,5-dimethylphenyl)ethanamine chloride
MOLECULAR FORMULA: C10H15ClN-
MOLECULAR WEIGHT: 184.6858
SMILES: CC1=CC(=CC(=C1)CCN)C.[Cl-]
Structure:
CAS RN: 6942-06-9
CAS Name: 2-[dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]ammonio]acetate
OPENEYE Name: 2-[dimethyl-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonio]acetate
IUPAC Name: 2-[dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azaniumyl]acetate
SYSTEMATIC NAME: 2-[dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azaniumyl]ethanoate
MOLECULAR FORMULA: C22H37NO4
MOLECULAR WEIGHT: 379.53348
SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC(=O)[O-]
Structure:
CAS RN: 5424-87-3
CAS Name: 1-(2,3-dimethoxyphenyl)-5-(4-morpholinyl)-1-penten-3-one chloride
OPENEYE Name: 1-(2,3-dimethoxyphenyl)-5-morpholino-pent-1-en-3-one chloride
IUPAC Name: 1-(2,3-dimethoxyphenyl)-5-morpholin-4-ylpent-1-en-3-one chloride
SYSTEMATIC NAME: 1-(2,3-dimethoxyphenyl)-5-morpholin-4-yl-pent-1-en-3-one chloride
MOLECULAR FORMULA: C17H23ClNO4-
MOLECULAR WEIGHT: 340.82182
SMILES: COC1=CC=CC(=C1OC)C=CC(=O)CCN2CCOCC2.[Cl-]
Structure:
CAS RN: 15262-52-9
CAS Name: 2-[(1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-1,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-6-yl]ethyl-diethyl-methylammonium iodide
OPENEYE Name: 2-[(1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-1,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-6-yl]ethyl-diethyl-methyl-ammonium iodide
IUPAC Name: 2-[(1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-1,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-6-yl]ethyl-diethyl-methylazanium iodide
SYSTEMATIC NAME: 2-[(1S,3aS,3bR,9aR,9bS,11aS)-1,9a,11a-trimethyl-1-oxidanyl-7-oxidanylidene-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-6-yl]ethyl-diethyl-methyl-azanium iodide
MOLECULAR FORMULA: C26H45IN2O2
MOLECULAR WEIGHT: 544.55217
SMILES: CC[N+](C)(CC)CCN1C(=O)CC[C@]2(C1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)C.[I-]
Structure:
CAS RN: 82280-63-5
CAS Name: nitric acid; nitric acid 2-[bis(2-nitrooxyethyl)amino]ethyl ester
OPENEYE Name: 2-[bis(2-nitrooxyethyl)amino]ethyl nitrate; nitric acid
IUPAC Name: 2-[bis(2-nitrooxyethyl)amino]ethyl nitrate; nitric acid
SYSTEMATIC NAME: 2-[bis(2-nitrooxyethyl)amino]ethyl nitrate; nitric acid
MOLECULAR FORMULA: C6H13N5O12
MOLECULAR WEIGHT: 347.19372
SMILES: C(CO[N+](=O)[O-])N(CCO[N+](=O)[O-])CCO[N+](=O)[O-].[N+](=O)(O)[O-]
Structure:
CAS RN: 7144-60-7
CAS Name: 5-[(E)-2-nitroethenyl]-2-propoxyaniline chloride
OPENEYE Name: 5-[(E)-2-nitrovinyl]-2-propoxy-aniline chloride
IUPAC Name: 5-[(E)-2-nitroethenyl]-2-propoxyaniline chloride
SYSTEMATIC NAME: 5-[(E)-2-nitroethenyl]-2-propoxy-aniline chloride
MOLECULAR FORMULA: C11H14ClN2O3-
MOLECULAR WEIGHT: 257.69346
SMILES: CCCOC1=C(C=C(C=C1)/C=C/[N+](=O)[O-])N.[Cl-]
Structure:
CAS RN: 5300-49-2
CAS Name: N1,N3,N5-tris[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
OPENEYE Name: N1,N3,N5-tris[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
IUPAC Name: 1-N,3-N,5-N-tris[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
SYSTEMATIC NAME: N1,N3,N5-tris[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
MOLECULAR FORMULA: C36H33ClN9O3-
MOLECULAR WEIGHT: 675.15872
SMILES: C1CN=C(N1)C2=CC(=CC=C2)NC(=O)C3=CC(=CC(=C3)C(=O)NC4=CC=CC(=C4)C5=NCCN5)C(=O)NC6=CC=CC(=C6)C7=NCCN7.[Cl-]
Structure:
CAS RN: 5373-31-9
CAS Name: N1,N3,N5-tris[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
OPENEYE Name: N1,N3,N5-tris[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
IUPAC Name: 1-N,3-N,5-N-tris[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
SYSTEMATIC NAME: N1,N3,N5-tris[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3,5-tricarboxamide chloride
MOLECULAR FORMULA: C36H33ClN9O3-
MOLECULAR WEIGHT: 675.15872
SMILES: C1CN=C(N1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)C(=O)NC4=CC=C(C=C4)C5=NCCN5)C(=O)NC6=CC=C(C=C6)C7=NCCN7.[Cl-]
Structure:
CAS RN: 5580-68-7
CAS Name: N1,N5-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,5-dicarboxamide chloride
OPENEYE Name: N1,N5-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,5-dicarboxamide chloride
IUPAC Name: 1-N,5-N-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,5-dicarboxamide chloride
SYSTEMATIC NAME: N1,N5-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,5-dicarboxamide chloride
MOLECULAR FORMULA: C30H26ClN6O2-
MOLECULAR WEIGHT: 538.01944
SMILES: C1CN=C(N1)C2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3C=CC=C4C(=O)NC5=CC=C(C=C5)C6=NCCN6.[Cl-]
Structure:
CAS RN: 13725-66-1
CAS Name: N1',N4'-dimethyl-N1,N4-bis[4-[methylamino(methylimino)methyl]phenyl]benzene-1,4-dicarboximidamide chloride
OPENEYE Name: N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-N1',N4'-dimethyl-benzene-1,4-dicarboxamidine chloride
IUPAC Name: 1-N,4-N-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-1-N',4-N'-dimethylbenzene-1,4-dicarboximidamide chloride
SYSTEMATIC NAME: N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-N1',N4'-dimethyl-benzene-1,4-dicarboximidamide chloride
MOLECULAR FORMULA: C28H34ClN8-
MOLECULAR WEIGHT: 518.07616
SMILES: CNC(=NC)C1=CC=C(C=C1)NC(=NC)C2=CC=C(C=C2)C(=NC)NC3=CC=C(C=C3)C(=NC)NC.[Cl-]
Structure:
CAS RN: 13836-45-8
CAS Name: N1',N4'-diethyl-N1,N4-bis[4-[ethylamino(methylimino)methyl]phenyl]benzene-1,4-dicarboximidamide chloride
OPENEYE Name: N1',N4'-diethyl-N1,N4-bis[4-(N-ethyl-N'-methyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamidine chloride
IUPAC Name: 1-N',4-N'-diethyl-1-N,4-N-bis[4-(N-ethyl-N'-methylcarbamimidoyl)phenyl]benzene-1,4-dicarboximidamide chloride
SYSTEMATIC NAME: N1',N4'-diethyl-N1,N4-bis[4-(N-ethyl-N'-methyl-carbamimidoyl)phenyl]benzene-1,4-dicarboximidamide chloride
MOLECULAR FORMULA: C32H42ClN8-
MOLECULAR WEIGHT: 574.18248
SMILES: CCNC(=NC)C1=CC=C(C=C1)NC(=NCC)C2=CC=C(C=C2)C(=NCC)NC3=CC=C(C=C3)C(=NC)NCC.[Cl-]
Structure:
CAS RN: 2053-23-8
CAS Name: N1',N4'-bis[4-[amino(methylimino)methyl]phenyl]benzene-1,4-dicarboximidamide hydrochloride
OPENEYE Name: N1',N4'-bis[4-(N'-methylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamidine hydrochloride
IUPAC Name: 1-N',4-N'-bis[4-(N'-methylcarbamimidoyl)phenyl]benzene-1,4-dicarboximidamide hydrochloride
SYSTEMATIC NAME: N1',N4'-bis[4-(N'-methylcarbamimidoyl)phenyl]benzene-1,4-dicarboximidamide hydrochloride
MOLECULAR FORMULA: C24H27ClN8
MOLECULAR WEIGHT: 462.97778
SMILES: CN=C(C1=CC=C(C=C1)N=C(C2=CC=C(C=C2)C(=NC3=CC=C(C=C3)C(=NC)N)N)N)N.Cl
Structure:
CAS RN: 5300-73-2
CAS Name: N1,N4-bis[3-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
OPENEYE Name: N1,N4-bis[3-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]terephthalamide chloride
IUPAC Name: 1-N,4-N-bis[3-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
SYSTEMATIC NAME: N1,N4-bis[3-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
MOLECULAR FORMULA: C28H28ClN6O2-
MOLECULAR WEIGHT: 516.01392
SMILES: C1CNC(=NC1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=CC(=C4)C5=NCCCN5.[Cl-]
Structure:
CAS RN: 73-53-0
CAS Name: N1,N4-bis[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
OPENEYE Name: N1,N4-bis[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]terephthalamide chloride
IUPAC Name: 1-N,4-N-bis[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
SYSTEMATIC NAME: N1,N4-bis[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzene-1,4-dicarboxamide chloride
MOLECULAR FORMULA: C28H28ClN6O2-
MOLECULAR WEIGHT: 516.01392
SMILES: C1CNC(=NC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=NCCCN5.[Cl-]
Structure:
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