CAS RN: 173046-07-6
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 183146-85-2
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 37263-48-2
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 50974-47-5
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 50975-72-9
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 912349-55-4
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 94469-14-4
CAS Name: 2-propenoic acid 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
IUPAC Name: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate
MOLECULAR FORMULA: C26H42O6
MOLECULAR WEIGHT: 450.60808
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C
Structure:
CAS RN: 127-52-6
CAS Name: sodium benzenesulfonyl(chloro)azanide
OPENEYE Name: sodium benzenesulfonyl(chloro)azanide
IUPAC Name: sodium benzenesulfonyl(chloro)azanide
SYSTEMATIC NAME: sodium chloranyl(phenylsulfonyl)azanide
MOLECULAR FORMULA: C6H5ClNNaO2S
MOLECULAR WEIGHT: 213.61717
SMILES: C1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]
Structure:
CAS RN: 136687-81-5
CAS Name: sodium benzenesulfonyl(chloro)azanide
OPENEYE Name: sodium benzenesulfonyl(chloro)azanide
IUPAC Name: sodium benzenesulfonyl(chloro)azanide
SYSTEMATIC NAME: sodium chloranyl(phenylsulfonyl)azanide
MOLECULAR FORMULA: C6H5ClNNaO2S
MOLECULAR WEIGHT: 213.61717
SMILES: C1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]
Structure:
CAS RN: 67973-18-6
CAS Name: sodium benzenesulfonyl(chloro)azanide
OPENEYE Name: sodium benzenesulfonyl(chloro)azanide
IUPAC Name: sodium benzenesulfonyl(chloro)azanide
SYSTEMATIC NAME: sodium chloranyl(phenylsulfonyl)azanide
MOLECULAR FORMULA: C6H5ClNNaO2S
MOLECULAR WEIGHT: 213.61717
SMILES: C1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]
Structure:
CAS RN: 72793-58-9
CAS Name: sodium benzenesulfonyl(chloro)azanide
OPENEYE Name: sodium benzenesulfonyl(chloro)azanide
IUPAC Name: sodium benzenesulfonyl(chloro)azanide
SYSTEMATIC NAME: sodium chloranyl(phenylsulfonyl)azanide
MOLECULAR FORMULA: C6H5ClNNaO2S
MOLECULAR WEIGHT: 213.61717
SMILES: C1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]
Structure:
CAS RN: 103501-83-3
CAS Name: 7-chloro-9-methyl-3,4-dihydro-2H-1-benzoxepin-5-one
OPENEYE Name: 7-chloro-9-methyl-3,4-dihydro-2H-1-benzoxepin-5-one
IUPAC Name: 7-chloro-9-methyl-3,4-dihydro-2H-1-benzoxepin-5-one
SYSTEMATIC NAME: 7-chloranyl-9-methyl-3,4-dihydro-2H-1-benzoxepin-5-one
MOLECULAR FORMULA: C11H11ClO2
MOLECULAR WEIGHT: 210.65684
SMILES: CC1=C2C(=CC(=C1)Cl)C(=O)CCCO2
Structure:
CAS RN: 779-26-0
CAS Name: 1-(2-biphenylenyl)ethanone
OPENEYE Name: 1-biphenylen-2-ylethanone
IUPAC Name: 1-biphenylen-2-ylethanone
SYSTEMATIC NAME: 1-biphenylen-2-ylethanone
MOLECULAR FORMULA: C14H10O
MOLECULAR WEIGHT: 194.2286
SMILES: CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C32
Structure:
CAS RN: 16233-04-8
CAS Name: N-(7-fluoro-3-nitro-9-oxo-2-fluorenyl)acetamide
OPENEYE Name: N-(7-fluoro-3-nitro-9-oxo-fluoren-2-yl)acetamide
IUPAC Name: N-(7-fluoro-3-nitro-9-oxofluoren-2-yl)acetamide
SYSTEMATIC NAME: N-(7-fluoranyl-3-nitro-9-oxidanylidene-fluoren-2-yl)ethanamide
MOLECULAR FORMULA: C15H9FN2O4
MOLECULAR WEIGHT: 300.241363
SMILES: CC(=O)NC1=C(C=C2C3=C(C=C(C=C3)F)C(=O)C2=C1)[N+](=O)[O-]
Structure:
CAS RN: 89001-53-6
CAS Name: 2-methyl-4-nitrobenzonitrile
OPENEYE Name: 2-methyl-4-nitro-benzonitrile
IUPAC Name: 2-methyl-4-nitrobenzonitrile
SYSTEMATIC NAME: 2-methyl-4-nitro-benzenecarbonitrile
MOLECULAR FORMULA: C8H6N2O2
MOLECULAR WEIGHT: 162.14544
SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])C#N
Structure:
CAS RN: 23497-36-1
CAS Name: 4-chloro-N-(4-chlorophenyl)-6-methyl-2-pyrimidinamine
OPENEYE Name: 4-chloro-N-(4-chlorophenyl)-6-methyl-pyrimidin-2-amine
IUPAC Name: 4-chloro-N-(4-chlorophenyl)-6-methylpyrimidin-2-amine
SYSTEMATIC NAME: 4-chloranyl-N-(4-chlorophenyl)-6-methyl-pyrimidin-2-amine
MOLECULAR FORMULA: C11H9Cl2N3
MOLECULAR WEIGHT: 254.11526
SMILES: CC1=CC(=NC(=N1)NC2=CC=C(C=C2)Cl)Cl
Structure:
CAS RN: 87096-84-2
CAS Name: N-[1-[[1-[[1-[[1-[[2-[[1-[[1-[[1-amino-4-(methylthio)-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopr
OPENEYE Name: 2-[(2-aminoacetyl)amino]-N-[1-[[2-[[2-[[1-[[2-[[2-[[1-benzyl-2-[(1-carbamoyl-3-methylsulfanyl-propyl)amino]-2-oxo-ethyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-hydroxy-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-i
IUPAC Name: 2-[(2-aminoacetyl)amino]-N-[1-[[1-[[1-[[1-[[2-[[1-[[1-[(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino
SYSTEMATIC NAME: 2-(2-azanylethanoylamino)-N-[1-[[1-[[1-[[1-[[2-[[1-[[1-[(1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-3-oxidany
MOLECULAR FORMULA: C52H73N15O12S
MOLECULAR WEIGHT: 1132.29432
SMILES: CC(C)CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(C)C(=O)NC(C(C)O)C(=O)NCC(=O)NC(CC3=CN=CN3)C(=O)NC(CC4=CC=CC=C4)C(=O)NC(CCSC)C(=O)N)NC(=O)C(CC(=O)N)NC(=O)CN
Structure:
CAS RN: 42135-32-0
CAS Name: 2-amino-3-nitro-9-fluorenone
OPENEYE Name: 2-amino-3-nitro-fluoren-9-one
IUPAC Name: 2-amino-3-nitrofluoren-9-one
SYSTEMATIC NAME: 2-azanyl-3-nitro-fluoren-9-one
MOLECULAR FORMULA: C13H8N2O3
MOLECULAR WEIGHT: 240.21422
SMILES: C1=CC=C2C(=C1)C3=CC(=C(C=C3C2=O)N)[N+](=O)[O-]
Structure:
CAS RN: 81882-12-4
CAS Name: 2-(thiophen-2-ylmethyl)guanidine
OPENEYE Name: 2-(2-thienylmethyl)guanidine
IUPAC Name: 2-(thiophen-2-ylmethyl)guanidine
SYSTEMATIC NAME: 2-(thiophen-2-ylmethyl)guanidine
MOLECULAR FORMULA: C6H9N3S
MOLECULAR WEIGHT: 155.22076
SMILES: C1=CSC(=C1)CN=C(N)N
Structure:
CAS RN: 175526-97-3
CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolidinyl]acetic acid
OPENEYE Name: 2-(1-tert-butoxycarbonylpyrrolidin-3-yl)acetic acid
IUPAC Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]ethanoic acid
MOLECULAR FORMULA: C11H19NO4
MOLECULAR WEIGHT: 229.27286
SMILES: CC(C)(C)OC(=O)N1CCC(C1)CC(=O)O
Structure:
CAS RN: 302912-35-2
CAS Name: 7-chloro-1,2,3,4-tetrahydrocyclopenta[b]indole
OPENEYE Name: 7-chloro-1,2,3,4-tetrahydrocyclopenta[b]indole
IUPAC Name: 7-chloro-1,2,3,4-tetrahydrocyclopenta[b]indole
SYSTEMATIC NAME: 7-chloranyl-1,2,3,4-tetrahydrocyclopenta[b]indole
MOLECULAR FORMULA: C11H10ClN
MOLECULAR WEIGHT: 191.6568
SMILES: C1CC2=C(C1)NC3=C2C=C(C=C3)Cl
Structure:
CAS RN: 13755-29-8
CAS Name: sodium tetrafluoroborate
OPENEYE Name: sodium tetrafluoroborate
IUPAC Name: sodium tetrafluoroborate
SYSTEMATIC NAME: sodium tetrafluoroborate
MOLECULAR FORMULA: BF4Na
MOLECULAR WEIGHT: 109.794383
SMILES: [B-](F)(F)(F)F.[Na+]
Structure:
CAS RN: 109704-86-1
CAS Name: sodium tetrafluoroborate
OPENEYE Name: sodium tetrafluoroborate
IUPAC Name: sodium tetrafluoroborate
SYSTEMATIC NAME: sodium tetrafluoroborate
MOLECULAR FORMULA: BF4Na
MOLECULAR WEIGHT: 109.794383
SMILES: [B-](F)(F)(F)F.[Na+]
Structure:
CAS RN: 12712-70-8
CAS Name: sodium tetrafluoroborate
OPENEYE Name: sodium tetrafluoroborate
IUPAC Name: sodium tetrafluoroborate
SYSTEMATIC NAME: sodium tetrafluoroborate
MOLECULAR FORMULA: BF4Na
MOLECULAR WEIGHT: 109.794383
SMILES: [B-](F)(F)(F)F.[Na+]
Structure:
CAS RN: 5366-42-7
CAS Name: 4-[6-(2-naphthalenyloxy)hexyl]morpholine
OPENEYE Name: 4-[6-(2-naphthyloxy)hexyl]morpholine
IUPAC Name: 4-(6-naphthalen-2-yloxyhexyl)morpholine
SYSTEMATIC NAME: 4-(6-naphthalen-2-yloxyhexyl)morpholine
MOLECULAR FORMULA: C20H27NO2
MOLECULAR WEIGHT: 313.43388
SMILES: C1COCCN1CCCCCCOC2=CC3=CC=CC=C3C=C2
Structure:
CAS RN: 2748-02-9
CAS Name: 2-amino-4-methylpentanoic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-4-methyl-pentanoate
IUPAC Name: tert-butyl 2-amino-4-methylpentanoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-4-methyl-pentanoate
MOLECULAR FORMULA: C10H21NO2
MOLECULAR WEIGHT: 187.27924
SMILES: CC(C)CC(C(=O)OC(C)(C)C)N
Structure:
CAS RN: 849936-29-4
CAS Name: 2-(3,4-dichlorophenyl)propanedial
OPENEYE Name: 2-(3,4-dichlorophenyl)propanedial
IUPAC Name: 2-(3,4-dichlorophenyl)propanedial
SYSTEMATIC NAME: 2-(3,4-dichlorophenyl)propanedial
MOLECULAR FORMULA: C9H6Cl2O2
MOLECULAR WEIGHT: 217.04874
SMILES: C1=CC(=C(C=C1C(C=O)C=O)Cl)Cl
Structure:
CAS RN: 24152-41-8
CAS Name: 4-(2-phenylethyl)piperidine
OPENEYE Name: 4-(2-phenylethyl)piperidine
IUPAC Name: 4-(2-phenylethyl)piperidine
SYSTEMATIC NAME: 4-(2-phenylethyl)piperidine
MOLECULAR FORMULA: C13H19N
MOLECULAR WEIGHT: 189.29666
SMILES: C1CNCCC1CCC2=CC=CC=C2
Structure:
CAS RN: 514842-98-9
CAS Name: 3-(1-pyrrolidinylmethyl)piperidine
OPENEYE Name: 3-(pyrrolidin-1-ylmethyl)piperidine
IUPAC Name: 3-(pyrrolidin-1-ylmethyl)piperidine
SYSTEMATIC NAME: 3-(pyrrolidin-1-ylmethyl)piperidine
MOLECULAR FORMULA: C10H20N2
MOLECULAR WEIGHT: 168.2792
SMILES: C1CCN(C1)CC2CCCNC2
Structure:
CAS RN: 325778-59-4
CAS Name: 2-(4-bromophenoxy)propanehydrazide
OPENEYE Name: 2-(4-bromophenoxy)propanehydrazide
IUPAC Name: 2-(4-bromophenoxy)propanehydrazide
SYSTEMATIC NAME: 2-(4-bromanylphenoxy)propanehydrazide
MOLECULAR FORMULA: C9H11BrN2O2
MOLECULAR WEIGHT: 259.09984
SMILES: CC(C(=O)NN)OC1=CC=C(C=C1)Br
Structure:
CAS RN: 886507-05-7
CAS Name: N-(3-piperidinylmethyl)propanamide
OPENEYE Name: N-(3-piperidylmethyl)propanamide
IUPAC Name: N-(piperidin-3-ylmethyl)propanamide
SYSTEMATIC NAME: N-(piperidin-3-ylmethyl)propanamide
MOLECULAR FORMULA: C9H18N2O
MOLECULAR WEIGHT: 170.25202
SMILES: CCC(=O)NCC1CCCNC1
Structure:
CAS RN: 71207-33-5
CAS Name: N-(4-piperidinylmethyl)acetamide
OPENEYE Name: N-(4-piperidylmethyl)acetamide
IUPAC Name: N-(piperidin-4-ylmethyl)acetamide
SYSTEMATIC NAME: N-(piperidin-4-ylmethyl)ethanamide
MOLECULAR FORMULA: C8H16N2O
MOLECULAR WEIGHT: 156.22544
SMILES: CC(=O)NCC1CCNCC1
Structure:
CAS RN: 4045-29-8
CAS Name: 3-methoxypiperidine
OPENEYE Name: 3-methoxypiperidine
IUPAC Name: 3-methoxypiperidine
SYSTEMATIC NAME: 3-methoxypiperidine
MOLECULAR FORMULA: C6H13NO
MOLECULAR WEIGHT: 115.17352
SMILES: COC1CCCNC1
Structure:
CAS RN: 669737-44-4
CAS Name: 3-[1-(4-methoxyphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 3-[1-(4-methoxyphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-[1-(4-methoxyphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-[1-(4-methoxyphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C12H15N3O2S
MOLECULAR WEIGHT: 265.3314
SMILES: CC(C1=NNC(=S)N1C)OC2=CC=C(C=C2)OC
Structure:
CAS RN: 49773-20-8
CAS Name: 2-methylsulfonylethanamine
OPENEYE Name: 2-methylsulfonylethanamine
IUPAC Name: 2-methylsulfonylethanamine
SYSTEMATIC NAME: 2-methylsulfonylethanamine
MOLECULAR FORMULA: C3H9NO2S
MOLECULAR WEIGHT: 123.17406
SMILES: CS(=O)(=O)CCN
Structure:
CAS RN: 39221-42-6
CAS Name: 2-(3-oxo-1H-isoindol-2-yl)acetate
OPENEYE Name: 2-(1-oxoisoindolin-2-yl)acetate
IUPAC Name: 2-(3-oxo-1H-isoindol-2-yl)acetate
SYSTEMATIC NAME: 2-(3-oxidanylidene-1H-isoindol-2-yl)ethanoate
MOLECULAR FORMULA: C10H8NO3-
MOLECULAR WEIGHT: 190.17542
SMILES: C1C2=CC=CC=C2C(=O)N1CC(=O)[O-]
Structure:
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