CAS RN: 59948-35-5
CAS Name: 3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-12-oxido-7-oxo-2-porphyrin-21-idyl]propanoate; hydron; iron(2+)
OPENEYE Name: ferrous; 3-[8,13-bis(carboxylatomethyl)-18-[(E)-2-carboxylatovinyl]-3,8,13,17-tetramethyl-12-oxido-7-oxo-porphyrin-21-id-2-yl]propanoate; hydron
IUPAC Name: 3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-12-oxido-7-oxoporphyrin-21-id-2-yl]propanoate; hydron; iron(2+)
SYSTEMATIC NAME: hydron; iron(2+); 3-[3,8,13,17-tetramethyl-12-oxidanidyl-8,13-bis(2-oxidanidyl-2-oxidanylidene-ethyl)-18-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-7-oxidanylidene-porphyrin-21-id-2-yl]propanoate
MOLECULAR FORMULA: C34H30FeN4O10
MOLECULAR WEIGHT: 710.4678
SMILES: [H+].[H+].[H+].[H+].CC1=C(C2=CC3=NC(=CC4=NC(=C(C4(C)CC(=O)[O-])[O-])C=C5C(C(=O)C(=N5)C=C1[N-]2)(C)CC(=O)[O-])C(=C3/C=C/C(=O)[O-])C)CCC(=O)[O-].[Fe+2]
Structure:
CAS RN: 91700-92-4
CAS Name: carbamic acid [(2R,3S,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-2,5,11-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester
OPENEYE Name: [(2R,3S,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-2,5,11-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
IUPAC Name: [(2R,3S,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-2,5,11-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
SYSTEMATIC NAME: [(2R,3S,5R,6S,7R,8E,10R,11R,12Z,14E)-2,5,11-trimethoxy-3,7,9,15-tetramethyl-6-oxidanyl-16,20,22-tris(oxidanylidene)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
MOLECULAR FORMULA: C29H40N2O9
MOLECULAR WEIGHT: 560.6359
SMILES: C[C@H]1C[C@H]([C@H]([C@@H](/C=C(/[C@H]([C@@H](/C=C\C=C(\C(=O)NC2=CC(=O)C=C([C@@H]1OC)C2=O)/C)OC)OC(=O)N)\C)C)O)OC
Structure:
CAS RN: 91632-07-4
CAS Name: (E)-9-octadecenoic acid [3-[hydroxy-[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethoxy]phosphoryl]oxy-2-[(E)-1-oxooctadec-9-enoxy]propyl] ester
OPENEYE Name: [3-[hydroxy-[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethoxy]phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxy-propyl] (E)-octadec-9-enoate
IUPAC Name: [3-[hydroxy-[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethoxy]phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate
SYSTEMATIC NAME: [3-[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethoxy-oxidanyl-phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxy-propyl] (E)-octadec-9-enoate
MOLECULAR FORMULA: C47H79N4O11P
MOLECULAR WEIGHT: 907.124121
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OCCNC1=CC=C(C2=NON=C12)[N+](=O)[O-])OC(=O)CCCCCCC/C=C/CCCCCCCC
Structure:
CAS RN: 91625-75-1
CAS Name: (1S,3E)-3-[(2E)-2-[(3R,3aS,7aS)-3a-methyl-3-[(2R)-6-methylheptan-2-yl]-2,3,4,6,7,7a-hexahydro-1H-inden-5-ylidene]-1-fluoroethylidene]-4-methylene-1-cyclohexanol
OPENEYE Name: (1S,3E)-3-[(2E)-2-[(3R,3aS,7aS)-3-[(1R)-1,5-dimethylhexyl]-3a-methyl-2,3,4,6,7,7a-hexahydro-1H-inden-5-ylidene]-1-fluoro-ethylidene]-4-methylene-cyclohexanol
IUPAC Name: (1S,3E)-3-[(2E)-2-[(3R,3aS,7aS)-3a-methyl-3-[(2R)-6-methylheptan-2-yl]-2,3,4,6,7,7a-hexahydro-1H-inden-5-ylidene]-1-fluoroethylidene]-4-methylidenecyclohexan-1-ol
SYSTEMATIC NAME: (1S,3E)-3-[(2E)-2-[(3R,3aS,7aS)-3a-methyl-3-[(2R)-6-methylheptan-2-yl]-2,3,4,6,7,7a-hexahydro-1H-inden-5-ylidene]-1-fluoranyl-ethylidene]-4-methylidene-cyclohexan-1-ol
MOLECULAR FORMULA: C27H43FO
MOLECULAR WEIGHT: 402.628123
SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(C/C(=C/C(=C\3/C[C@H](CCC3=C)O)/F)/CC2)C
Structure:
CAS RN: 91593-18-9
CAS Name: acetic acid [(2R,3S,5R)-3-acetyloxy-5-[5-[(E)-2-bromoethenyl]-2,4-dioxo-1-pyrimidinyl]-2-oxolanyl]methyl ester
OPENEYE Name: [(2R,3S,5R)-3-acetoxy-5-[5-[(E)-2-bromovinyl]-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [(2R,3S,5R)-3-acetyloxy-5-[5-[(E)-2-bromoethenyl]-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [(2R,3S,5R)-3-acetyloxy-5-[5-[(E)-2-bromanylethenyl]-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C15H17BrN2O7
MOLECULAR WEIGHT: 417.20868
SMILES: CC(=O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)/C=C/Br)OC(=O)C
Structure:
CAS RN: 91549-17-6
CAS Name: 5-[(E)-nonadec-5-enyl]benzene-1,3-diol
OPENEYE Name: 5-[(E)-nonadec-5-enyl]benzene-1,3-diol
IUPAC Name: 5-[(E)-nonadec-5-enyl]benzene-1,3-diol
SYSTEMATIC NAME: 5-[(E)-nonadec-5-enyl]benzene-1,3-diol
MOLECULAR FORMULA: C25H42O2
MOLECULAR WEIGHT: 374.59978
SMILES: CCCCCCCCCCCCC/C=C/CCCCC1=CC(=CC(=C1)O)O
Structure:
CAS RN: 91549-05-2
CAS Name: 2-[[(E)-2-[[2-[[2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]-3-methylpentanoic acid
OPENEYE Name: 2-[[(E)-2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenyl-prop-2-enoyl]amino]-3-methyl-pentanoic acid
IUPAC Name: 2-[[(E)-2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]acetyl]amino]-3-phenylprop-2-enoyl]amino]-3-methylpentanoic acid
SYSTEMATIC NAME: 2-[[(E)-2-[2-[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]ethanoylamino]-3-phenyl-prop-2-enoyl]amino]-3-methyl-pentanoic acid
MOLECULAR FORMULA: C29H37N5O7
MOLECULAR WEIGHT: 567.63338
SMILES: CCC(C)C(C(=O)O)NC(=O)/C(=C\C1=CC=CC=C1)/NC(=O)CNC(=O)C(C)NC(=O)C(CC2=CC=C(C=C2)O)N
Structure:
CAS RN: 91425-25-1
CAS Name: (E,5S)-5-amino-6-methyl-3-octenoic acid
OPENEYE Name: (E,5S)-5-amino-6-methyl-oct-3-enoic acid
IUPAC Name: (E,5S)-5-amino-6-methyloct-3-enoic acid
SYSTEMATIC NAME: (E,5S)-5-azanyl-6-methyl-oct-3-enoic acid
MOLECULAR FORMULA: C9H17NO2
MOLECULAR WEIGHT: 171.23678
SMILES: CCC(C)[C@@H](/C=C/CC(=O)O)N
Structure:
CAS RN: 103500-27-2
CAS Name: (E)-3-(1-aminocyclopropyl)-2-propenoic acid
OPENEYE Name: (E)-3-(1-aminocyclopropyl)prop-2-enoic acid
IUPAC Name: (E)-3-(1-aminocyclopropyl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(1-azanylcyclopropyl)prop-2-enoic acid
MOLECULAR FORMULA: C6H9NO2
MOLECULAR WEIGHT: 127.14116
SMILES: C1CC1(/C=C/C(=O)O)N
Structure:
CAS RN: 102564-38-5
CAS Name: 2-(2,5-dioxo-1-pyrrolidinyl)-4-[(E)-2-nitroethenyl]benzoate
OPENEYE Name: 2-(2,5-dioxopyrrolidin-1-yl)-4-[(E)-2-nitrovinyl]benzoate
IUPAC Name: 2-(2,5-dioxopyrrolidin-1-yl)-4-[(E)-2-nitroethenyl]benzoate
SYSTEMATIC NAME: 2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-[(E)-2-nitroethenyl]benzoate
MOLECULAR FORMULA: C13H9N2O6-
MOLECULAR WEIGHT: 289.22036
SMILES: C1CC(=O)N(C1=O)C2=C(C=CC(=C2)/C=C/[N+](=O)[O-])C(=O)[O-]
Structure:
CAS RN: 102910-24-7
CAS Name: (8E,10E,14E)-5,12,20-trihydroxyeicosa-8,10,14-trienoic acid
OPENEYE Name: (8E,10E,14E)-5,12,20-trihydroxyicosa-8,10,14-trienoic acid
IUPAC Name: (8E,10E,14E)-5,12,20-trihydroxyicosa-8,10,14-trienoic acid
SYSTEMATIC NAME: (8E,10E,14E)-5,12,20-tris(oxidanyl)icosa-8,10,14-trienoic acid
MOLECULAR FORMULA: C20H34O5
MOLECULAR WEIGHT: 354.48096
SMILES: C(CC/C=C/CC(/C=C/C=C/CCC(CCCC(=O)O)O)O)CCO
Structure:
CAS RN: 102910-23-6
CAS Name: (6E,8E,14E)-5,12,20-trihydroxyeicosa-6,8,14-trienoic acid
OPENEYE Name: (6E,8E,14E)-5,12,20-trihydroxyicosa-6,8,14-trienoic acid
IUPAC Name: (6E,8E,14E)-5,12,20-trihydroxyicosa-6,8,14-trienoic acid
SYSTEMATIC NAME: (6E,8E,14E)-5,12,20-tris(oxidanyl)icosa-6,8,14-trienoic acid
MOLECULAR FORMULA: C20H34O5
MOLECULAR WEIGHT: 354.48096
SMILES: C(CC/C=C/CC(CC/C=C/C=C/C(CCCC(=O)O)O)O)CCO
Structure:
CAS RN: 102275-60-5
CAS Name: 3-[(Z)-3-(5,5-dimethyl-4-oxo-2-furanyl)but-2-enoxy]-9-xanthenone
OPENEYE Name: 3-[(Z)-3-(5,5-dimethyl-4-oxo-2-furyl)but-2-enoxy]xanthen-9-one
IUPAC Name: 3-[(Z)-3-(5,5-dimethyl-4-oxofuran-2-yl)but-2-enoxy]xanthen-9-one
SYSTEMATIC NAME: 3-[(Z)-3-(5,5-dimethyl-4-oxidanylidene-furan-2-yl)but-2-enoxy]xanthen-9-one
MOLECULAR FORMULA: C23H20O5
MOLECULAR WEIGHT: 376.4019
SMILES: C/C(=C/COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3O2)/C4=CC(=O)C(O4)(C)C
Structure:
CAS RN: 101973-23-3
CAS Name: (5E,8E,11Z,14E,17E)-12-hydroperoxyeicosa-5,8,11,14,17-pentaenoic acid
OPENEYE Name: (5E,8E,11Z,14E,17E)-12-hydroperoxyicosa-5,8,11,14,17-pentaenoic acid
IUPAC Name: (5E,8E,11Z,14E,17E)-12-hydroperoxyicosa-5,8,11,14,17-pentaenoic acid
SYSTEMATIC NAME: (5E,8E,11Z,14E,17E)-12-(dioxidanyl)icosa-5,8,11,14,17-pentaenoic acid
MOLECULAR FORMULA: C20H30O4
MOLECULAR WEIGHT: 334.4498
SMILES: CC/C=C/C/C=C/C/C(=C/C/C=C/C/C=C/CCCC(=O)O)/OO
Structure:
CAS RN: 99300-77-3
CAS Name: (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine
OPENEYE Name: (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylene]-4H-pyridazin-3-amine
IUPAC Name: (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine
SYSTEMATIC NAME: (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine
MOLECULAR FORMULA: C15H16F3N3
MOLECULAR WEIGHT: 295.30285
SMILES: CC\1=NN=C(C/C1=C\C2=CC(=CC=C2)C(F)(F)F)N(C)C
Structure:
CAS RN: 97613-68-8
CAS Name: 1-[(4E)-6,10-dimethylundeca-4,9-dienoxy]-2,3,5-trimethylbenzene
OPENEYE Name: 1-[(4E)-6,10-dimethylundeca-4,9-dienoxy]-2,3,5-trimethyl-benzene
IUPAC Name: 1-[(4E)-6,10-dimethylundeca-4,9-dienoxy]-2,3,5-trimethylbenzene
SYSTEMATIC NAME: 1-[(4E)-6,10-dimethylundeca-4,9-dienoxy]-2,3,5-trimethyl-benzene
MOLECULAR FORMULA: C22H34O
MOLECULAR WEIGHT: 314.50476
SMILES: CC1=CC(=C(C(=C1)OCCC/C=C/C(C)CCC=C(C)C)C)C
Structure:
CAS RN: 95061-94-2
CAS Name: (E)-5-(2-carboxyethylthio)-4-hydroxy-6-nonadecenoic acid
OPENEYE Name: (E)-5-(2-carboxyethylsulfanyl)-4-hydroxy-nonadec-6-enoic acid
IUPAC Name: (E)-5-(2-carboxyethylsulfanyl)-4-hydroxynonadec-6-enoic acid
SYSTEMATIC NAME: (E)-5-(3-hydroxy-3-oxopropylsulfanyl)-4-oxidanyl-nonadec-6-enoic acid
MOLECULAR FORMULA: C22H40O5S
MOLECULAR WEIGHT: 416.615
SMILES: CCCCCCCCCCCC/C=C/C(C(CCC(=O)O)O)SCCC(=O)O
Structure:
CAS RN: 127941-81-5
CAS Name: 2-benzoyl-8-[3-[(E)-but-1-enyl]-2-oxiranyl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
OPENEYE Name: 2-benzoyl-8-[3-[(E)-but-1-enyl]oxiran-2-yl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
IUPAC Name: 2-benzoyl-8-[3-[(E)-but-1-enyl]oxiran-2-yl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
SYSTEMATIC NAME: 8-[3-[(E)-but-1-enyl]oxiran-2-yl]-2-methoxy-7-methyl-1-oxidanyl-2-(phenylcarbonyl)-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
MOLECULAR FORMULA: C22H23NO7
MOLECULAR WEIGHT: 413.42052
SMILES: CC/C=C/C1C(O1)C2=C(C(=O)C3(O2)C(C(NC3=O)(C(=O)C4=CC=CC=C4)OC)O)C
Structure:
CAS RN: 129047-94-5
CAS Name: (2E,6E)-4-hydroxynona-2,6-dienal
OPENEYE Name: (2E,6E)-4-hydroxynona-2,6-dienal
IUPAC Name: (2E,6E)-4-hydroxynona-2,6-dienal
SYSTEMATIC NAME: (2E,6E)-4-oxidanylnona-2,6-dienal
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: CC/C=C/CC(/C=C/C=O)O
Structure:
CAS RN: 127654-03-9
CAS Name: (6Z)-6-(6-methyl-5-oxo-11-pyrido[4,3-c][1]benzazepinylidene)hexanoic acid
OPENEYE Name: (6Z)-6-(6-methyl-5-oxo-pyrido[4,3-c][1]benzazepin-11-ylidene)hexanoic acid
IUPAC Name: (6Z)-6-(6-methyl-5-oxopyrido[4,3-c][1]benzazepin-11-ylidene)hexanoic acid
SYSTEMATIC NAME: (6Z)-6-(6-methyl-5-oxidanylidene-pyrido[4,3-c][1]benzazepin-11-ylidene)hexanoic acid
MOLECULAR FORMULA: C20H20N2O3
MOLECULAR WEIGHT: 336.3844
SMILES: CN1C2=CC=CC=C2/C(=C/CCCCC(=O)O)/C3=C(C1=O)C=CN=C3
Structure:
CAS RN: 58849-86-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C37H47NO13
MOLECULAR WEIGHT: 713.76798
SMILES: CC1/C=C/C=C(\C(=O)NC2=C(C(=O)C3=C(C(=C(C(=C3C2=O)O)C)O)C(=O)/C(=C\C(C(C(C(C(C(C(C1O)C)O)C(=O)OC)O)C)O)(C)O)/C)C)/C
Structure:
CAS RN: 127216-46-0
CAS Name: (2E,4E,6E,8E)-dotriaconta-2,4,6,8-tetraenoic acid
OPENEYE Name: (2E,4E,6E,8E)-dotriaconta-2,4,6,8-tetraenoic acid
IUPAC Name: (2E,4E,6E,8E)-dotriaconta-2,4,6,8-tetraenoic acid
SYSTEMATIC NAME: (2E,4E,6E,8E)-dotriaconta-2,4,6,8-tetraenoic acid
MOLECULAR FORMULA: C32H56O2
MOLECULAR WEIGHT: 472.78584
SMILES: CCCCCCCCCCCCCCCCCCCCCCC/C=C/C=C/C=C/C=C/C(=O)O
Structure:
CAS RN: 126959-78-2
CAS Name: (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]phenyl]-2-propenoic acid
OPENEYE Name: (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]vinyl]phenyl]prop-2-enoic acid
IUPAC Name: (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]phenyl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxidanylidene-1,4-benzoxazin-3-yl]ethenyl]phenyl]prop-2-enoic acid
MOLECULAR FORMULA: C21H18N2O4
MOLECULAR WEIGHT: 362.37862
SMILES: CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)/C=C/C3=CC=C(C=C3)/C=C/C(=O)O
Structure:
CAS RN: 126836-12-2
CAS Name: 2-[2-[(Z)-hexadec-7-enyl]-1-(2-hydroxyethyl)-1-imidazol-1-iumyl]ethanol chloride
OPENEYE Name: 2-[2-[(Z)-hexadec-7-enyl]-1-(2-hydroxyethyl)imidazol-1-ium-1-yl]ethanol chloride
IUPAC Name: 2-[2-[(Z)-hexadec-7-enyl]-1-(2-hydroxyethyl)imidazol-1-ium-1-yl]ethanol chloride
SYSTEMATIC NAME: 2-[2-[(Z)-hexadec-7-enyl]-1-(2-hydroxyethyl)imidazol-1-ium-1-yl]ethanol chloride
MOLECULAR FORMULA: C23H43ClN2O2
MOLECULAR WEIGHT: 415.05272
SMILES: CCCCCCCC/C=C\CCCCCCC1=NC=C[N+]1(CCO)CCO.[Cl-]
Structure:
CAS RN: 126622-45-5
CAS Name: (3Z)-3-dodec-11-ynylidene-5-(hydroxymethyl)-2-oxolanone
OPENEYE Name: (3Z)-3-dodec-11-ynylidene-5-(hydroxymethyl)tetrahydrofuran-2-one
IUPAC Name: (3Z)-3-dodec-11-ynylidene-5-(hydroxymethyl)oxolan-2-one
SYSTEMATIC NAME: (3Z)-3-dodec-11-ynylidene-5-(hydroxymethyl)oxolan-2-one
MOLECULAR FORMULA: C17H26O3
MOLECULAR WEIGHT: 278.38654
SMILES: C#CCCCCCCCCC/C=C\1/CC(OC1=O)CO
Structure:
CAS RN: 126602-16-2
CAS Name: 4-[(3Z)-3-[(3S,5S)-3,5-dimethyl-6-oxo-2-piperidinylidene]-2-oxopropyl]piperidine-2,6-dione
OPENEYE Name: 4-[(3Z)-3-[(3S,5S)-3,5-dimethyl-6-oxo-2-piperidylidene]-2-oxo-propyl]piperidine-2,6-dione
IUPAC Name: 4-[(3Z)-3-[(3S,5S)-3,5-dimethyl-6-oxopiperidin-2-ylidene]-2-oxopropyl]piperidine-2,6-dione
SYSTEMATIC NAME: 4-[(3Z)-3-[(3S,5S)-3,5-dimethyl-6-oxidanylidene-piperidin-2-ylidene]-2-oxidanylidene-propyl]piperidine-2,6-dione
MOLECULAR FORMULA: C15H20N2O4
MOLECULAR WEIGHT: 292.3303
SMILES: C[C@H]\1C[C@@H](C(=O)N/C1=C\C(=O)CC2CC(=O)NC(=O)C2)C
Structure:
CAS RN: 126584-06-3
CAS Name: 2-[[(E)-7,13-dihydroxy-1-oxooctadec-2-enyl]amino]ethanesulfonic acid
OPENEYE Name: 2-[[(E)-7,13-dihydroxyoctadec-2-enoyl]amino]ethanesulfonic acid
IUPAC Name: 2-[[(E)-7,13-dihydroxyoctadec-2-enoyl]amino]ethanesulfonic acid
SYSTEMATIC NAME: 2-[[(E)-7,13-bis(oxidanyl)octadec-2-enoyl]amino]ethanesulfonic acid
MOLECULAR FORMULA: C20H39NO6S
MOLECULAR WEIGHT: 421.59176
SMILES: CCCCCC(CCCCCC(CCC/C=C/C(=O)NCCS(=O)(=O)O)O)O
Structure:
CAS RN: 126582-77-2
CAS Name: (Z)-3-chloro-2-phosphonooxy-2-propenoic acid
OPENEYE Name: (Z)-3-chloro-2-phosphonooxy-prop-2-enoic acid
IUPAC Name: (Z)-3-chloro-2-phosphonooxyprop-2-enoic acid
SYSTEMATIC NAME: (Z)-3-chloranyl-2-phosphonooxy-prop-2-enoic acid
MOLECULAR FORMULA: C3H4ClO6P
MOLECULAR WEIGHT: 202.487021
SMILES: C(=C(/C(=O)O)\OP(=O)(O)O)\Cl
Structure:
CAS RN: 89499-17-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H64N4O12
MOLECULAR WEIGHT: 865.01996
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NN5CCN(CC5)CC(C)C)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 58702-12-8
CAS Name: (5Z)-5-[(2Z)-2-(1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene)ethylidene]-4-methylenecyclohexane-1,3-diol
OPENEYE Name: (5Z)-5-[(2Z)-2-(1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene)ethylidene]-4-methylene-cyclohexane-1,3-diol
IUPAC Name: (5Z)-5-[(2Z)-2-(1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene)ethylidene]-4-methylidenecyclohexane-1,3-diol
SYSTEMATIC NAME: (5Z)-5-[(2Z)-2-(1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene)ethylidene]-4-methylidene-cyclohexane-1,3-diol
MOLECULAR FORMULA: C21H32O2
MOLECULAR WEIGHT: 316.47758
SMILES: CCC1CCC\2C1(CCC/C2=C/C=C\3/CC(CC(C3=C)O)O)C
Structure:
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