CAS RN: 92169-46-5
CAS Name: benzoic acid (3-hydroxy-2,2-dimethylpropyl) ester; 2,2-bis(hydroxymethyl)propane-1,3-diol; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethyl-propyl) benzoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethylpropyl) benzoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (2,2-dimethyl-3-oxidanyl-propyl) benzoate
MOLECULAR FORMULA: C25H32O10
MOLECULAR WEIGHT: 492.51558
SMILES: CC(C)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
CAS RN: 85938-44-9
CAS Name: (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid [[dioctyl-[(9E,12E,15E)-1-oxooctadeca-9,12,15-trienoxy]stannyl]oxy-dioctylstannyl] ester
OPENEYE Name: [[[(9E,12E,15E)-octadeca-9,12,15-trienoyl]oxy-dioctyl-stannyl]oxy-dioctyl-stannyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
IUPAC Name: [[[(9E,12E,15E)-octadeca-9,12,15-trienoyl]oxy-dioctylstannyl]oxy-dioctylstannyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
SYSTEMATIC NAME: [[[(9E,12E,15E)-octadeca-9,12,15-trienoyl]oxy-dioctyl-stannyl]oxy-dioctyl-stannyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
MOLECULAR FORMULA: C68H126O5Sn2
MOLECULAR WEIGHT: 1261.14504
SMILES: CCCCCCCC[Sn](CCCCCCCC)(OC(=O)CCCCCCC/C=C/C/C=C/C/C=C/CC)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
CAS RN: 79570-08-4
CAS Name: (E)-3-(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)-2-propenenitrile
OPENEYE Name: (E)-3-(6,6-dimethylnorpinan-2-yl)prop-2-enenitrile
IUPAC Name: (E)-3-(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)prop-2-enenitrile
MOLECULAR FORMULA: C12H17N
MOLECULAR WEIGHT: 175.27008
SMILES: CC1(C2CCC(C1C2)/C=C/C#N)C
CAS RN: 85409-69-4
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (E)-4-[3-dodecoxypropyl(2-hydroxyethyl)amino]-4-oxo-2-butenoic acid; 2-[dodecyl(2-hydroxyethyl)amino]ethanol
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (E)-4-[3-dodecoxypropyl(2-hydroxyethyl)amino]-4-oxo-but-2-enoic acid; 2-[dodecyl(2-hydroxyethyl)amino]ethanol
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (E)-4-[3-dodecoxypropyl(2-hydroxyethyl)amino]-4-oxobut-2-enoic acid; 2-[dodecyl(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; (E)-4-[3-dodecoxypropyl(2-hydroxyethyl)amino]-4-oxidanylidene-but-2-enoic acid; 2-[dodecyl(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C43H89N3O10
MOLECULAR WEIGHT: 808.18086
SMILES: CCCCCCCCCCCCN(CCO)CCO.CCCCCCCCCCCCOCCCN(CCO)C(=O)/C=C/C(=O)O.C(CO)N(CCO)CCO
CAS RN: 93904-82-6
CAS Name: 14-(1-oxoprop-2-enylamino)-1-tetradecanesulfonic acid
OPENEYE Name: 14-(prop-2-enoylamino)tetradecane-1-sulfonic acid
IUPAC Name: 14-(prop-2-enoylamino)tetradecane-1-sulfonic acid
SYSTEMATIC NAME: 14-(prop-2-enoylamino)tetradecane-1-sulfonic acid
MOLECULAR FORMULA: C17H33NO4S
MOLECULAR WEIGHT: 347.51322
SMILES: C=CC(=O)NCCCCCCCCCCCCCCS(=O)(=O)O
CAS RN: 95041-38-6
CAS Name: disodium 3,5-dichloro-2-hydroxybenzenesulfonate
OPENEYE Name: disodium 3,5-dichloro-2-hydroxy-benzenesulfonate
IUPAC Name: disodium 3,5-dichloro-2-hydroxybenzenesulfonate
SYSTEMATIC NAME: disodium 3,5-bis(chloranyl)-2-oxidanyl-benzenesulfonate
MOLECULAR FORMULA: C12H6Cl4Na2O8S2
MOLECULAR WEIGHT: 530.09278
SMILES: C1=C(C=C(C(=C1Cl)O)S(=O)(=O)[O-])Cl.C1=C(C=C(C(=C1Cl)O)S(=O)(=O)[O-])Cl.[Na+].[Na+]
CAS RN: 69087-47-4
CAS Name: 1,1,2,2-tetrafluoroethene; 2,2,3,3-tetrafluoro-3-[1,1,1,2,3,3-hexafluoro-3-(1,2,2-trifluoroethenoxy)propan-2-yl]oxypropanoic acid
OPENEYE Name: 3-[1-[difluoro(1,2,2-trifluorovinyloxy)methyl]-1,2,2,2-tetrafluoro-ethoxy]-2,2,3,3-tetrafluoro-propanoic acid; 1,1,2,2-tetrafluoroethylene
IUPAC Name: 1,1,2,2-tetrafluoroethene; 2,2,3,3-tetrafluoro-3-[1,1,1,2,3,3-hexafluoro-3-(1,2,2-trifluoroethenoxy)propan-2-yl]oxypropanoic acid
SYSTEMATIC NAME: 1,1,2,2-tetrakis(fluoranyl)ethene; 2,2,3,3-tetrakis(fluoranyl)-3-[1,1,1,2,3,3-hexakis(fluoranyl)-3-[1,2,2-tris(fluoranyl)ethenoxy]propan-2-yl]oxy-propanoic acid
MOLECULAR FORMULA: C10HF17O4
MOLECULAR WEIGHT: 508.085394
SMILES: C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(C(=O)O)(F)F)(F)F)F)(F)F)F.C(=C(F)F)(F)F
CAS RN: 93841-61-3
CAS Name: acetic acid; 2-(6-methoxy-1-methyl-9H-carbazol-2-yl)-N-methylethanamine
OPENEYE Name: acetic acid; 2-(6-methoxy-1-methyl-9H-carbazol-2-yl)-N-methyl-ethanamine
IUPAC Name: acetic acid; 2-(6-methoxy-1-methyl-9H-carbazol-2-yl)-N-methylethanamine
SYSTEMATIC NAME: ethanoic acid; 2-(6-methoxy-1-methyl-9H-carbazol-2-yl)-N-methyl-ethanamine
MOLECULAR FORMULA: C19H24N2O3
MOLECULAR WEIGHT: 328.40546
SMILES: CC1=C(C=CC2=C1NC3=C2C=C(C=C3)OC)CCNC.CC(=O)O
CAS RN: 85940-46-1
CAS Name: 2-cyclohexylphenolate; [dichloro(phenyl)methyl]-dodecyl-dimethylammonium
OPENEYE Name: 2-cyclohexylphenolate; [dichloro(phenyl)methyl]-dodecyl-dimethyl-ammonium
IUPAC Name: 2-cyclohexylphenolate; [dichloro(phenyl)methyl]-dodecyl-dimethylazanium
SYSTEMATIC NAME: [bis(chloranyl)-phenyl-methyl]-dodecyl-dimethyl-azanium; 2-cyclohexylphenolate
MOLECULAR FORMULA: C33H51Cl2NO
MOLECULAR WEIGHT: 548.67014
SMILES: CCCCCCCCCCCC[N+](C)(C)C(C1=CC=CC=C1)(Cl)Cl.C1CCC(CC1)C2=CC=CC=C2[O-]
CAS RN: 93963-66-7
CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine; (2S)-5-oxo-2-pyrrolidinecarboxylic acid
OPENEYE Name: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenyl-methyl]piperazine; (2S)-5-oxopyrrolidine-2-carboxylic acid
IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine; (2S)-5-oxopyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenyl-methyl]piperazine; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C38H47ClN4O6
MOLECULAR WEIGHT: 691.25598
SMILES: CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.C1CC(=O)N[C@@H]1C(=O)O.C1CC(=O)N[C@@H]1C(=O)O
CAS RN: 83898-12-8
CAS Name: (2S)-2-[formyl(1-phenylethyl)amino]-3-oxopropanoic acid methyl ester
OPENEYE Name: methyl (2S)-2-[formyl(1-phenylethyl)amino]-3-oxo-propanoate
IUPAC Name: methyl (2S)-2-[formyl(1-phenylethyl)amino]-3-oxopropanoate
SYSTEMATIC NAME: methyl (2S)-2-[methanoyl(1-phenylethyl)amino]-3-oxidanylidene-propanoate
MOLECULAR FORMULA: C13H15NO4
MOLECULAR WEIGHT: 249.2625
SMILES: CC(C1=CC=CC=C1)N(C=O)[C@@H](C=O)C(=O)OC
CAS RN: 79135-86-7
CAS Name: N-(4-benzamido-3-methoxy-9,10-dioxo-1-anthracenyl)benzamide
OPENEYE Name: N-(4-benzamido-3-methoxy-9,10-dioxo-1-anthryl)benzamide
IUPAC Name: N-(4-benzamido-3-methoxy-9,10-dioxoanthracen-1-yl)benzamide
SYSTEMATIC NAME: N-[4-benzamido-3-methoxy-9,10-bis(oxidanylidene)anthracen-1-yl]benzamide
MOLECULAR FORMULA: C29H20N2O5
MOLECULAR WEIGHT: 476.4795
SMILES: COC1=C(C2=C(C(=C1)NC(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O)NC(=O)C5=CC=CC=C5
CAS RN: 72906-41-3
CAS Name: cyclohexanamine; 2-[methyl-[(E)-1-oxooctadec-9-enyl]amino]acetic acid
OPENEYE Name: cyclohexanamine; 2-[methyl-[(E)-octadec-9-enoyl]amino]acetic acid
IUPAC Name: cyclohexanamine; 2-[methyl-[(E)-octadec-9-enoyl]amino]acetic acid
SYSTEMATIC NAME: cyclohexanamine; 2-[methyl-[(E)-octadec-9-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C27H52N2O3
MOLECULAR WEIGHT: 452.71338
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)N(C)CC(=O)O.C1CCC(CC1)N
CAS RN: 70788-50-0
CAS Name: 4-(4-acetamidoanilino)-1-amino-9,10-dioxo-2-anthracenesulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
OPENEYE Name: 4-(4-acetamidoanilino)-1-amino-9,10-dioxo-anthracene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
IUPAC Name: 4-(4-acetamidoanilino)-1-amino-9,10-dioxoanthracene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 4-[(4-acetamidophenyl)amino]-1-azanyl-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C28H32N4O9S
MOLECULAR WEIGHT: 600.64008
SMILES: CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.C(CO)N(CCO)CCO
CAS RN: 156965-06-9
CAS Name: (E,3R,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethyl-4-heptenoic acid propan-2-yl ester
OPENEYE Name: isopropyl (E,3R,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethyl-hept-4-enoate
IUPAC Name: propan-2-yl (E,3R,6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethylhept-4-enoate
SYSTEMATIC NAME: propan-2-yl (E,3R,6R)-6-[(1R,4E,7aR)-7a-methyl-4-[(2Z)-2-[(3S,5R)-2-methylidene-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2,2-dimethyl-3-oxidanyl-hept-4-enoate
MOLECULAR FORMULA: C31H48O5
MOLECULAR WEIGHT: 500.70982
SMILES: C[C@H](/C=C/[C@H](C(C)(C)C(=O)OC(C)C)O)[C@H]1CCC\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C
CAS RN: 73287-35-1
CAS Name: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid; 6-[4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexyl]oxy-6-oxohexanoic acid; 2-(2-hydroxyethoxy)ethanol
OPENEYE Name: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid; 6-[4-[1-(4-hydroxycyclohexyl)-1-methyl-ethyl]cyclohexoxy]-6-oxo-hexanoic acid; 2-(2-hydroxyethoxy)ethanol
IUPAC Name: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid; 6-[4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexyl]oxy-6-oxohexanoic acid; 2-(2-hydroxyethoxy)ethanol
SYSTEMATIC NAME: 1,2,3,4,7,7-hexakis(chloranyl)bicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid; 2-(2-hydroxyethyloxy)ethanol; 6-[4-[2-(4-oxidanylcyclohexyl)propan-2-yl]cyclohexyl]oxy-6-oxidanylidene-hexanoic acid
MOLECULAR FORMULA: C34H50Cl6O12
MOLECULAR WEIGHT: 863.4716
SMILES: CC(C)(C1CCC(CC1)O)C2CCC(CC2)OC(=O)CCCCC(=O)O.C(COCCO)O.C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O
CAS RN: 73612-38-1
CAS Name: barium(2+); 2-[(2E)-2-(4-oxo-1-naphthalenylidene)hydrazinyl]naphthalene-1,5-disulfonate
OPENEYE Name: barium(2+); 2-[(2E)-2-(4-oxo-1-naphthylidene)hydrazino]naphthalene-1,5-disulfonate
IUPAC Name: barium(2+); 2-[(2E)-2-(4-oxonaphthalen-1-ylidene)hydrazinyl]naphthalene-1,5-disulfonate
SYSTEMATIC NAME: barium(2+); 2-[(2E)-2-(4-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-1,5-disulfonate
MOLECULAR FORMULA: C20H12BaN2O7S2
MOLECULAR WEIGHT: 593.77548
SMILES: C1=CC=C2C(=O)C=C/C(=N\NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=C1.[Ba+2]
CAS RN: 11138-63-9
CAS Name: dihydroxy(dioxo)tungsten; stiboric acid
OPENEYE Name: dihydroxy(dioxo)tungsten; stiboric acid
IUPAC Name: dihydroxy(dioxo)tungsten; stiboric acid
SYSTEMATIC NAME: bis(oxidanyl)-bis(oxidanylidene)tungsten; stiboric acid
MOLECULAR FORMULA: H5O8SbW
MOLECULAR WEIGHT: 438.6349
SMILES: O[Sb](=O)(O)O.O[W](=O)(=O)O
CAS RN: 72829-20-0
CAS Name: 2-hydroxyethyl-dimethyl-[2-(1-oxooctadecoxy)ethyl]ammonium; methyl sulfate
OPENEYE Name: 2-hydroxyethyl-dimethyl-(2-octadecanoyloxyethyl)ammonium; methyl sulfate
IUPAC Name: 2-hydroxyethyl-dimethyl-(2-octadecanoyloxyethyl)azanium; methyl sulfate
SYSTEMATIC NAME: 2-hydroxyethyl-dimethyl-(2-octadecanoyloxyethyl)azanium; methyl sulfate
MOLECULAR FORMULA: C25H53NO7S
MOLECULAR WEIGHT: 511.75582
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CCO.COS(=O)(=O)[O-]
CAS RN: 85068-51-5
CAS Name: 10-undecenoic acid 2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl ester
OPENEYE Name: 2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl undec-10-enoate
IUPAC Name: 2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl undec-10-enoate
SYSTEMATIC NAME: 2-[2-[2-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl undec-10-enoate
MOLECULAR FORMULA: C25H48O9
MOLECULAR WEIGHT: 492.64322
SMILES: C=CCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCO
CAS RN: 74398-80-4
CAS Name: 4-benzamido-2-sulfobenzenediazonium chloride
OPENEYE Name: 4-benzamido-2-sulfo-benzenediazonium chloride
IUPAC Name: 4-benzamido-2-sulfobenzenediazonium chloride
SYSTEMATIC NAME: 4-benzamido-2-sulfo-benzenediazonium chloride
MOLECULAR FORMULA: C13H10ClN3O4S
MOLECULAR WEIGHT: 339.7542
SMILES: C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[N+]#N)S(=O)(=O)O.[Cl-]
CAS RN: 85223-06-9
CAS Name: (3Z)-3-[(3E)-3-(2,4-dioxo-1H-quinolin-3-ylidene)-1-isoindolylidene]-1H-quinoline-2,4-dione
OPENEYE Name: (3Z)-3-[(3E)-3-(2,4-dioxo-1H-quinolin-3-ylidene)isoindolin-1-ylidene]-1H-quinoline-2,4-dione
IUPAC Name: (3Z)-3-[(3E)-3-(2,4-dioxo-1H-quinolin-3-ylidene)isoindol-1-ylidene]-1H-quinoline-2,4-dione
SYSTEMATIC NAME: (3Z)-3-[(3E)-3-[2,4-bis(oxidanylidene)-1H-quinolin-3-ylidene]isoindol-1-ylidene]-1H-quinoline-2,4-dione
MOLECULAR FORMULA: C26H15N3O4
MOLECULAR WEIGHT: 433.415
SMILES: C1=CC=C\2C(=C1)/C(=C\3/C(=O)C4=CC=CC=C4NC3=O)/N/C2=C\5/C(=O)C6=CC=CC=C6NC5=O
CAS RN: 97417-02-2
CAS Name: 3-(3-hydroxy-1-prop-2-enoxypropoxy)propane-1,2-diol
OPENEYE Name: 3-(1-allyloxy-3-hydroxy-propoxy)propane-1,2-diol
IUPAC Name: 3-(3-hydroxy-1-prop-2-enoxypropoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(3-oxidanyl-1-prop-2-enoxy-propoxy)propane-1,2-diol
MOLECULAR FORMULA: C9H18O5
MOLECULAR WEIGHT: 206.23622
SMILES: C=CCOC(CCO)OCC(CO)O
CAS RN: 75199-02-9
CAS Name: sodium 5-amino-2-(2-ethoxyanilino)benzenesulfonate
OPENEYE Name: sodium 5-amino-2-(2-ethoxyanilino)benzenesulfonate
IUPAC Name: sodium 5-amino-2-(2-ethoxyanilino)benzenesulfonate
SYSTEMATIC NAME: sodium 5-azanyl-2-[(2-ethoxyphenyl)amino]benzenesulfonate
MOLECULAR FORMULA: C14H15N2NaO4S
MOLECULAR WEIGHT: 330.33467
SMILES: CCOC1=CC=CC=C1NC2=C(C=C(C=C2)N)S(=O)(=O)[O-].[Na+]
CAS RN: 85223-19-4
CAS Name: 2'-[(4-chlorophenyl)methylamino]-6'-(dibutylamino)-1-spiro[isobenzofuran-3,9'-xanthene]one
OPENEYE Name: 2'-[(4-chlorophenyl)methylamino]-6'-(dibutylamino)spiro[isobenzofuran-3,9'-xanthene]-1-one
IUPAC Name: 2'-[(4-chlorophenyl)methylamino]-6'-(dibutylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one
SYSTEMATIC NAME: 2'-[(4-chlorophenyl)methylamino]-6'-(dibutylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one
MOLECULAR FORMULA: C35H35ClN2O3
MOLECULAR WEIGHT: 567.117
SMILES: CCCCN(CCCC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)NCC6=CC=C(C=C6)Cl
CAS RN: 93841-65-7
CAS Name: (Z)-9-octadecenoic acid [2-[(Z)-heptadec-8-enyl]-4-[[(Z)-1-oxooctadec-9-enoxy]methyl]-5H-oxazol-4-yl]methyl ester
OPENEYE Name: [2-[(Z)-heptadec-8-enyl]-4-[[(Z)-octadec-9-enoyl]oxymethyl]-5H-oxazol-4-yl]methyl (Z)-octadec-9-enoate
IUPAC Name: [2-[(Z)-heptadec-8-enyl]-4-[[(Z)-octadec-9-enoyl]oxymethyl]-5H-1,3-oxazol-4-yl]methyl (Z)-octadec-9-enoate
SYSTEMATIC NAME: [2-[(Z)-heptadec-8-enyl]-4-[[(Z)-octadec-9-enoyl]oxymethyl]-5H-1,3-oxazol-4-yl]methyl (Z)-octadec-9-enoate
MOLECULAR FORMULA: C58H105NO5
MOLECULAR WEIGHT: 896.458
SMILES: CCCCCCCC/C=C\CCCCCCCC1=NC(CO1)(COC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC
CAS RN: 94135-80-5
CAS Name: acetic acid; (E)-N-(2-aminoethyl)-9-octadecenamide
OPENEYE Name: acetic acid; (E)-N-(2-aminoethyl)octadec-9-enamide
IUPAC Name: acetic acid; (E)-N-(2-aminoethyl)octadec-9-enamide
SYSTEMATIC NAME: (E)-N-(2-azanylethyl)octadec-9-enamide; ethanoic acid
MOLECULAR FORMULA: C22H44N2O3
MOLECULAR WEIGHT: 384.59636
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)NCCN.CC(=O)O
CAS RN: 85938-45-0
CAS Name: (9Z,12Z)-octadeca-9,12-dienoic acid [[dioctyl-[(9E,12E)-1-oxooctadeca-9,12-dienoxy]stannyl]oxy-dioctylstannyl] ester
OPENEYE Name: [[[(9E,12E)-octadeca-9,12-dienoyl]oxy-dioctyl-stannyl]oxy-dioctyl-stannyl] (9Z,12Z)-octadeca-9,12-dienoate
IUPAC Name: [[[(9E,12E)-octadeca-9,12-dienoyl]oxy-dioctylstannyl]oxy-dioctylstannyl] (9Z,12Z)-octadeca-9,12-dienoate
SYSTEMATIC NAME: [[[(9E,12E)-octadeca-9,12-dienoyl]oxy-dioctyl-stannyl]oxy-dioctyl-stannyl] (9Z,12Z)-octadeca-9,12-dienoate
MOLECULAR FORMULA: C68H130O5Sn2
MOLECULAR WEIGHT: 1265.1768
SMILES: CCCCCCCC[Sn](CCCCCCCC)(OC(=O)CCCCCCC/C=C/C/C=C/CCCCC)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
CAS RN: 83949-79-5
CAS Name: hydrogen sulfate; (2E)-1,3,3-trimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-ium-1-ylidene)ethylidene]indole
OPENEYE Name: hydrogen sulfate; (2E)-1,3,3-trimethyl-2-[2-(2-methylindolin-1-ium-1-ylidene)ethylidene]indoline
IUPAC Name: hydrogen sulfate; (2E)-1,3,3-trimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-ium-1-ylidene)ethylidene]indole
SYSTEMATIC NAME: hydrogen sulfate; (2E)-1,3,3-trimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-ium-1-ylidene)ethylidene]indole
MOLECULAR FORMULA: C22H26N2O4S
MOLECULAR WEIGHT: 414.51784
SMILES: CC1CC2=CC=CC=C2[N+]1=C/C=C/3\C(C4=CC=CC=C4N3C)(C)C.OS(=O)(=O)[O-]
CAS RN: 73772-33-5
CAS Name: acetic acid; N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-1-hexanesulfonamide
OPENEYE Name: acetic acid; N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-hexane-1-sulfonamide
IUPAC Name: acetic acid; N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonamide
SYSTEMATIC NAME: N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexane-1-sulfonamide; ethanoic acid
MOLECULAR FORMULA: C13H17F13N2O4S
MOLECULAR WEIGHT: 544.329322
SMILES: CC(=O)O.CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
CAS RN: 192230-35-6
CAS Name: acetic acid ethenyl ester; (E)-2-butenedioic acid dioctyl ester; 2-methyl-2-propenoic acid 2-hydroxypropyl ester
OPENEYE Name: dioctyl (E)-but-2-enedioate; 2-hydroxypropyl 2-methylprop-2-enoate; vinyl acetate
IUPAC Name: dioctyl (E)-but-2-enedioate; ethenyl acetate; 2-hydroxypropyl 2-methylprop-2-enoate
SYSTEMATIC NAME: dioctyl (E)-but-2-enedioate; ethenyl ethanoate; 2-oxidanylpropyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C31H54O9
MOLECULAR WEIGHT: 570.75506
SMILES: CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC.CC(COC(=O)C(=C)C)O.CC(=O)OC=C
No comments:
Post a Comment