CAS RN: 4833-41-4
CAS Name: 1,2,3-tricyclohexylguanidine
OPENEYE Name: 1,2,3-tricyclohexylguanidine
IUPAC Name: 1,2,3-tricyclohexylguanidine
SYSTEMATIC NAME: 1,2,3-tricyclohexylguanidine
MOLECULAR FORMULA: C19H35N3
MOLECULAR WEIGHT: 305.5013
SMILES: C1CCC(CC1)NC(=NC2CCCCC2)NC3CCCCC3
Structure:
CAS RN: 35404-60-5
CAS Name: 2-[carbamimidoyl(2-mercaptoethyl)amino]acetic acid
OPENEYE Name: 2-[carbamimidoyl(2-sulfanylethyl)amino]acetic acid
IUPAC Name: 2-[carbamimidoyl(2-sulfanylethyl)amino]acetic acid
SYSTEMATIC NAME: 2-[carbamimidoyl(2-sulfanylethyl)amino]ethanoic acid
MOLECULAR FORMULA: C5H11N3O2S
MOLECULAR WEIGHT: 177.22474
SMILES: C(CS)N(CC(=O)O)C(=N)N
Structure:
CAS RN: 627-01-0
CAS Name: 2-(ethylamino)acetic acid
OPENEYE Name: 2-(ethylamino)acetic acid
IUPAC Name: 2-(ethylamino)acetic acid
SYSTEMATIC NAME: 2-(ethylamino)ethanoic acid
MOLECULAR FORMULA: C4H9NO2
MOLECULAR WEIGHT: 103.11976
SMILES: CCNCC(=O)O
Structure:
CAS RN: 66794-42-1
CAS Name: dimethoxyphosphoryl(iodo)methane
OPENEYE Name: dimethoxyphosphoryl(iodo)methane
IUPAC Name: dimethoxyphosphoryl(iodo)methane
SYSTEMATIC NAME: dimethoxyphosphoryl(iodanyl)methane
MOLECULAR FORMULA: C3H8IO3P
MOLECULAR WEIGHT: 249.972051
SMILES: COP(=O)(CI)OC
Structure:
CAS RN: 24918-26-1
CAS Name: 2-(2-imino-3-thiazolidinyl)acetic acid
OPENEYE Name: 2-(2-iminothiazolidin-3-yl)acetic acid
IUPAC Name: 2-(2-imino-1,3-thiazolidin-3-yl)acetic acid
SYSTEMATIC NAME: 2-(2-azanylidene-1,3-thiazolidin-3-yl)ethanoic acid
MOLECULAR FORMULA: C5H8N2O2S
MOLECULAR WEIGHT: 160.19422
SMILES: C1CSC(=N)N1CC(=O)O
Structure:
CAS RN: 35404-63-8
CAS Name: 2-[carbamimidoyl-(phenylmethyl)amino]acetic acid
OPENEYE Name: 2-[benzyl(carbamimidoyl)amino]acetic acid
IUPAC Name: 2-[benzyl(carbamimidoyl)amino]acetic acid
SYSTEMATIC NAME: 2-[carbamimidoyl-(phenylmethyl)amino]ethanoic acid
MOLECULAR FORMULA: C10H13N3O2
MOLECULAR WEIGHT: 207.22912
SMILES: C1=CC=C(C=C1)CN(CC(=O)O)C(=N)N
Structure:
CAS RN: 22584-00-5
CAS Name: 3-cyanobutanoic acid ethyl ester
OPENEYE Name: ethyl 3-cyanobutanoate
IUPAC Name: ethyl 3-cyanobutanoate
SYSTEMATIC NAME: ethyl 3-cyanobutanoate
MOLECULAR FORMULA: C7H11NO2
MOLECULAR WEIGHT: 141.16774
SMILES: CCOC(=O)CC(C)C#N
Structure:
CAS RN: 52555-36-9
CAS Name: 2-[1-iminoethyl(methyl)amino]acetic acid
OPENEYE Name: 2-[ethanimidoyl(methyl)amino]acetic acid
IUPAC Name: 2-[ethanimidoyl(methyl)amino]acetic acid
SYSTEMATIC NAME: 2-[ethanimidoyl(methyl)amino]ethanoic acid
MOLECULAR FORMULA: C5H10N2O2
MOLECULAR WEIGHT: 130.1451
SMILES: CC(=N)N(C)CC(=O)O
Structure:
CAS RN: 1197-13-3
CAS Name: 5-formyl-1H-pyrrole-2-carboxylic acid methyl ester
OPENEYE Name: methyl 5-formyl-1H-pyrrole-2-carboxylate
IUPAC Name: methyl 5-formyl-1H-pyrrole-2-carboxylate
SYSTEMATIC NAME: methyl 5-methanoyl-1H-pyrrole-2-carboxylate
MOLECULAR FORMULA: C7H7NO3
MOLECULAR WEIGHT: 153.13538
SMILES: COC(=O)C1=CC=C(N1)C=O
Structure:
CAS RN: 5207-07-8
CAS Name: 5-formyl-1H-pyrrole-2-carboxylic acid methyl ester
OPENEYE Name: methyl 5-formyl-1H-pyrrole-2-carboxylate
IUPAC Name: methyl 5-formyl-1H-pyrrole-2-carboxylate
SYSTEMATIC NAME: methyl 5-methanoyl-1H-pyrrole-2-carboxylate
MOLECULAR FORMULA: C7H7NO3
MOLECULAR WEIGHT: 153.13538
SMILES: COC(=O)C1=CC=C(N1)C=O
Structure:
CAS RN: 16269-23-1
CAS Name: 3,4-bis(phenylmethylene)oxolane-2,5-dione
OPENEYE Name: 3,4-dibenzylidenetetrahydrofuran-2,5-dione
IUPAC Name: 3,4-dibenzylideneoxolane-2,5-dione
SYSTEMATIC NAME: 3,4-bis(phenylmethylidene)oxolane-2,5-dione
MOLECULAR FORMULA: C18H12O3
MOLECULAR WEIGHT: 276.28608
SMILES: C1=CC=C(C=C1)C=C2C(=CC3=CC=CC=C3)C(=O)OC2=O
Structure:
CAS RN: 3969-59-3
CAS Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
OPENEYE Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
IUPAC Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
SYSTEMATIC NAME: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
MOLECULAR FORMULA: C15H26O6
MOLECULAR WEIGHT: 302.36334
SMILES: CC1(OCC(O1)C2C(OC(O2)(C)C)C3COC(O3)(C)C)C
Structure:
CAS RN: 81704-51-0
CAS Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
OPENEYE Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
IUPAC Name: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
SYSTEMATIC NAME: 4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
MOLECULAR FORMULA: C15H26O6
MOLECULAR WEIGHT: 302.36334
SMILES: CC1(OCC(O1)C2C(OC(O2)(C)C)C3COC(O3)(C)C)C
Structure:
CAS RN: 50884-99-6
CAS Name: 2-bromo-3-fluoroheptanoic acid
OPENEYE Name: 2-bromo-3-fluoro-heptanoic acid
IUPAC Name: 2-bromo-3-fluoroheptanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-heptanoic acid
MOLECULAR FORMULA: C7H12BrFO2
MOLECULAR WEIGHT: 227.071383
SMILES: CCCCC(C(C(=O)O)Br)F
Structure:
CAS RN: 50884-97-4
CAS Name: 2-bromo-3-fluorohexanoic acid
OPENEYE Name: 2-bromo-3-fluoro-hexanoic acid
IUPAC Name: 2-bromo-3-fluorohexanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-hexanoic acid
MOLECULAR FORMULA: C6H10BrFO2
MOLECULAR WEIGHT: 213.044803
SMILES: CCCC(C(C(=O)O)Br)F
Structure:
CAS RN: 50884-94-1
CAS Name: 2-bromo-3-fluoro-3-methylbutanoic acid
OPENEYE Name: 2-bromo-3-fluoro-3-methyl-butanoic acid
IUPAC Name: 2-bromo-3-fluoro-3-methylbutanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-3-methyl-butanoic acid
MOLECULAR FORMULA: C5H8BrFO2
MOLECULAR WEIGHT: 199.018223
SMILES: CC(C)(C(C(=O)O)Br)F
Structure:
CAS RN: 50884-95-2
CAS Name: 2-bromo-3-fluoropentanoic acid
OPENEYE Name: 2-bromo-3-fluoro-pentanoic acid
IUPAC Name: 2-bromo-3-fluoropentanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-pentanoic acid
MOLECULAR FORMULA: C5H8BrFO2
MOLECULAR WEIGHT: 199.018223
SMILES: CCC(C(C(=O)O)Br)F
Structure:
CAS RN: 50884-93-0
CAS Name: 2-bromo-3-fluorobutanoic acid
OPENEYE Name: 2-bromo-3-fluoro-butanoic acid
IUPAC Name: 2-bromo-3-fluorobutanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-butanoic acid
MOLECULAR FORMULA: C4H6BrFO2
MOLECULAR WEIGHT: 184.991643
SMILES: CC(C(C(=O)O)Br)F
Structure:
CAS RN: 39621-37-9
CAS Name: 2-bromo-3-fluoropropanoic acid
OPENEYE Name: 2-bromo-3-fluoro-propanoic acid
IUPAC Name: 2-bromo-3-fluoropropanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-propanoic acid
MOLECULAR FORMULA: C3H4BrFO2
MOLECULAR WEIGHT: 170.965063
SMILES: C(C(C(=O)O)Br)F
Structure:
CAS RN: 6245-49-4
CAS Name: 3-[3-(3-aminophenoxy)propoxy]aniline
OPENEYE Name: 3-[3-(3-aminophenoxy)propoxy]aniline
IUPAC Name: 3-[3-(3-aminophenoxy)propoxy]aniline
SYSTEMATIC NAME: 3-[3-(3-azanylphenoxy)propoxy]aniline
MOLECULAR FORMULA: C15H18N2O2
MOLECULAR WEIGHT: 258.31562
SMILES: C1=CC(=CC(=C1)OCCCOC2=CC=CC(=C2)N)N
Structure:
CAS RN: 5226-81-3
CAS Name: 3-[4-(3-aminophenoxy)butoxy]aniline
OPENEYE Name: 3-[4-(3-aminophenoxy)butoxy]aniline
IUPAC Name: 3-[4-(3-aminophenoxy)butoxy]aniline
SYSTEMATIC NAME: 3-[4-(3-azanylphenoxy)butoxy]aniline
MOLECULAR FORMULA: C16H20N2O2
MOLECULAR WEIGHT: 272.3422
SMILES: C1=CC(=CC(=C1)OCCCCOC2=CC=CC(=C2)N)N
Structure:
CAS RN: 29338-10-1
CAS Name: 2-hexadecylsulfonyl-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
OPENEYE Name: 2-hexadecylsulfonyl-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
IUPAC Name: 2-hexadecylsulfonyl-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
SYSTEMATIC NAME: 2-hexadecylsulfonyl-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
MOLECULAR FORMULA: C31H45N3O9S4
MOLECULAR WEIGHT: 731.9637
SMILES: CCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)NN=C2N(C3=C(S2)C=CC(=C3)S(=O)(=O)O)C)C(=O)O
Structure:
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