CAS RN: 109347-33-3
CAS Name: (3E,5E)-N-(3-methylbutan-2-yl)-6-phenylhexa-3,5-dienamide
OPENEYE Name: (3E,5E)-N-(1,2-dimethylpropyl)-6-phenyl-hexa-3,5-dienamide
IUPAC Name: (3E,5E)-N-(3-methylbutan-2-yl)-6-phenylhexa-3,5-dienamide
SYSTEMATIC NAME: (3E,5E)-N-(3-methylbutan-2-yl)-6-phenyl-hexa-3,5-dienamide
MOLECULAR FORMULA: C17H23NO
MOLECULAR WEIGHT: 257.37062
SMILES: CC(C)C(C)NC(=O)C/C=C/C=C/C1=CC=CC=C1
Structure:
CAS RN: 109279-26-7
CAS Name: (6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyloct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
OPENEYE Name: (6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyl-oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
IUPAC Name: (6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyloct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
SYSTEMATIC NAME: (6E,7R,8R,8aS)-6-[(E,6S)-2,5-dimethyl-6-oxidanyl-oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
MOLECULAR FORMULA: C19H33NO3
MOLECULAR WEIGHT: 323.47022
SMILES: CC[C@@H](/C(=C/CC(C)/C=C/1\CN2CCC[C@H]2[C@@]([C@@H]1O)(C)O)/C)O
Structure:
CAS RN: 109237-06-1
CAS Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(Z)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enoxy]methyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
OPENEYE Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(Z)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
SYSTEMATIC NAME: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-[[(Z)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-10-oxidanyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
MOLECULAR FORMULA: C40H56O7
MOLECULAR WEIGHT: 648.86844
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)COC(=O)/C=C\C6=CC(=C(C=C6)O)OC)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
Structure:
CAS RN: 109237-05-0
CAS Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enoxy]methyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
OPENEYE Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
SYSTEMATIC NAME: (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxymethyl]-1,2,6a,6b,9,12a-hexamethyl-10-oxidanyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
MOLECULAR FORMULA: C40H56O7
MOLECULAR WEIGHT: 648.86844
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)COC(=O)/C=C/C6=CC(=C(C=C6)O)OC)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
Structure:
CAS RN: 108905-66-4
CAS Name: 2-[(E)-2-[5-bromo-3-methyl-2-(methylthio)-4-imidazolyl]ethenyl]-5-methylpyrazine
OPENEYE Name: 2-[(E)-2-(5-bromo-3-methyl-2-methylsulfanyl-imidazol-4-yl)vinyl]-5-methyl-pyrazine
IUPAC Name: 2-[(E)-2-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)ethenyl]-5-methylpyrazine
SYSTEMATIC NAME: 2-[(E)-2-(5-bromanyl-3-methyl-2-methylsulfanyl-imidazol-4-yl)ethenyl]-5-methyl-pyrazine
MOLECULAR FORMULA: C12H13BrN4S
MOLECULAR WEIGHT: 325.22742
SMILES: CC1=NC=C(N=C1)/C=C/C2=C(N=C(N2C)SC)Br
Structure:
CAS RN: 108789-18-0
CAS Name: (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4H-pyran-3-carboxylic acid 2-(4-hydroxyphenyl)ethyl ester
OPENEYE Name: 2-(4-hydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxo-ethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4H-pyran-3-carboxylate
IUPAC Name: 2-(4-hydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
SYSTEMATIC NAME: 2-(4-hydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate
MOLECULAR FORMULA: C25H32O12
MOLECULAR WEIGHT: 524.51438
SMILES: C/C=C/1\[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OCCC3=CC=C(C=C3)O)CC(=O)OC
Structure:
CAS RN: 108789-17-9
CAS Name: (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4H-pyran-3-carboxylic acid 2-(3,4-dihydroxyphenyl)ethyl ester
OPENEYE Name: 2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxo-ethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4H-pyran-3-carboxylate
IUPAC Name: 2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]ethyl (4S,5E,6S)-5-ethylidene-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate
MOLECULAR FORMULA: C25H32O13
MOLECULAR WEIGHT: 540.51378
SMILES: C/C=C/1\[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OC
Structure:
CAS RN: 108789-16-8
CAS Name: (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4H-pyran-3-carboxylic acid 2-(3,4-dihydroxyphenyl)ethyl ester
OPENEYE Name: 2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxo-ethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4H-pyran-3-carboxylate
IUPAC Name: 2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]ethyl (4S,5E,6S)-4-[2-[2-[3,4-bis(oxidanyl)phenyl]ethoxy]-2-oxidanylidene-ethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
MOLECULAR FORMULA: C32H38O15
MOLECULAR WEIGHT: 662.63512
SMILES: C/C=C/1\[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OCCC4=CC(=C(C=C4)O)O
Structure:
CAS RN: 108340-84-7
CAS Name: (6Z)-1,12-dimethyl-9-(2-methylpropyl)-6-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (6Z)-6-benzylidene-9-isobutyl-1,12-dimethyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (6Z)-6-benzylidene-1,12-dimethyl-9-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (6Z)-1,12-dimethyl-9-(2-methylpropyl)-6-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C21H28N4O4
MOLECULAR WEIGHT: 400.47142
SMILES: CC1C(=O)NC(C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1C)CC(C)C
Structure:
CAS RN: 108331-93-7
CAS Name: (2E,4E)-N-(2-methylpropyl)-12-phenyldodeca-2,4-dienamide
OPENEYE Name: (2E,4E)-N-isobutyl-12-phenyl-dodeca-2,4-dienamide
IUPAC Name: (2E,4E)-N-(2-methylpropyl)-12-phenyldodeca-2,4-dienamide
SYSTEMATIC NAME: (2E,4E)-N-(2-methylpropyl)-12-phenyl-dodeca-2,4-dienamide
MOLECULAR FORMULA: C22H33NO
MOLECULAR WEIGHT: 327.50352
SMILES: CC(C)CNC(=O)/C=C/C=C/CCCCCCCC1=CC=CC=C1
Structure:
CAS RN: 108233-98-3
CAS Name: 2-[[(E)-2-[[2-[(2-amino-1-oxopropyl)amino]-4-methyl-1-oxopentyl]-methylamino]-1-oxo-3-phenylprop-2-enyl]amino]acetic acid
OPENEYE Name: 2-[[(E)-2-[[2-(2-aminopropanoylamino)-4-methyl-pentanoyl]-methyl-amino]-3-phenyl-prop-2-enoyl]amino]acetic acid
IUPAC Name: 2-[[(E)-2-[[2-(2-aminopropanoylamino)-4-methylpentanoyl]-methylamino]-3-phenylprop-2-enoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(E)-2-[[2-(2-azanylpropanoylamino)-4-methyl-pentanoyl]-methyl-amino]-3-phenyl-prop-2-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C21H30N4O5
MOLECULAR WEIGHT: 418.4867
SMILES: CC(C)CC(C(=O)N(C)/C(=C/C1=CC=CC=C1)/C(=O)NCC(=O)O)NC(=O)C(C)N
Structure:
CAS RN: 108233-97-2
CAS Name: 2-[[(E)-2-[[2-[(2-amino-1-oxopropyl)amino]-4-methyl-1-oxopentyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]acetic acid
OPENEYE Name: 2-[[(E)-2-[[2-(2-aminopropanoylamino)-4-methyl-pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]acetic acid
IUPAC Name: 2-[[(E)-2-[[2-(2-aminopropanoylamino)-4-methylpentanoyl]amino]-3-phenylprop-2-enoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(E)-2-[[2-(2-azanylpropanoylamino)-4-methyl-pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C20H28N4O5
MOLECULAR WEIGHT: 404.46012
SMILES: CC(C)CC(C(=O)N/C(=C/C1=CC=CC=C1)/C(=O)NCC(=O)O)NC(=O)C(C)N
Structure:
CAS RN: 108233-96-1
CAS Name: 2-[[(E)-2-[[4-methyl-2-[[2-(methylamino)-1-oxopropyl]amino]-1-oxopentyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]acetic acid
OPENEYE Name: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]acetic acid
IUPAC Name: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenylprop-2-enoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C21H30N4O5
MOLECULAR WEIGHT: 418.4867
SMILES: CC(C)CC(C(=O)N/C(=C/C1=CC=CC=C1)/C(=O)NCC(=O)O)NC(=O)C(C)NC
Structure:
CAS RN: 108340-87-0
CAS Name: 2-[[(E)-2-[[4-methyl-2-[[2-(methylamino)-1-oxopropyl]amino]-1-oxopentyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]acetic acid
OPENEYE Name: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]acetic acid
IUPAC Name: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenylprop-2-enoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(E)-2-[[4-methyl-2-[2-(methylamino)propanoylamino]pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]ethanoic acid
MOLECULAR FORMULA: C21H30N4O5
MOLECULAR WEIGHT: 418.4867
SMILES: CC(C)CC(C(=O)N/C(=C/C1=CC=CC=C1)/C(=O)NCC(=O)O)NC(=O)C(C)NC
Structure:
CAS RN: 108233-95-0
CAS Name: (12Z)-1,6-dimethyl-3-(2-methylpropyl)-12-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (12Z)-12-benzylidene-3-isobutyl-1,6-dimethyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (12Z)-12-benzylidene-1,6-dimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (12Z)-1,6-dimethyl-3-(2-methylpropyl)-12-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C21H28N4O4
MOLECULAR WEIGHT: 400.47142
SMILES: CC1C(=O)NC(C(=O)N(/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1)C)CC(C)C
Structure:
CAS RN: 108340-85-8
CAS Name: (12Z)-1,6-dimethyl-3-(2-methylpropyl)-12-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (12Z)-12-benzylidene-3-isobutyl-1,6-dimethyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (12Z)-12-benzylidene-1,6-dimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (12Z)-1,6-dimethyl-3-(2-methylpropyl)-12-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C21H28N4O4
MOLECULAR WEIGHT: 400.47142
SMILES: CC1C(=O)NC(C(=O)N(/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1)C)CC(C)C
Structure:
CAS RN: 108233-94-9
CAS Name: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (3Z)-3-benzylidene-6-isobutyl-9-methyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (3Z)-3-benzylidene-9-methyl-6-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C20H26N4O4
MOLECULAR WEIGHT: 386.44484
SMILES: CC1C(=O)NC(C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1)CC(C)C
Structure:
CAS RN: 108340-83-6
CAS Name: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (3Z)-3-benzylidene-6-isobutyl-9-methyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (3Z)-3-benzylidene-9-methyl-6-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C20H26N4O4
MOLECULAR WEIGHT: 386.44484
SMILES: CC1C(=O)NC(C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1)CC(C)C
Structure:
CAS RN: 108340-86-9
CAS Name: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
OPENEYE Name: (3Z)-3-benzylidene-6-isobutyl-9-methyl-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
IUPAC Name: (3Z)-3-benzylidene-9-methyl-6-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
SYSTEMATIC NAME: (3Z)-9-methyl-6-(2-methylpropyl)-3-(phenylmethylidene)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
MOLECULAR FORMULA: C20H26N4O4
MOLECULAR WEIGHT: 386.44484
SMILES: CC1C(=O)NC(C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCC(=O)N1)CC(C)C
Structure:
CAS RN: 108233-39-2
CAS Name: 2-[[(2S)-2-amino-3-[[(E)-4-methoxy-1,4-dioxobut-2-enyl]amino]-1-oxopropyl]amino]acetic acid
OPENEYE Name: 2-[[(2S)-2-amino-3-[[(E)-4-methoxy-4-oxo-but-2-enoyl]amino]propanoyl]amino]acetic acid
IUPAC Name: 2-[[(2S)-2-amino-3-[[(E)-4-methoxy-4-oxobut-2-enoyl]amino]propanoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[(2S)-2-azanyl-3-[[(E)-4-methoxy-4-oxidanylidene-but-2-enoyl]amino]propanoyl]amino]ethanoic acid
MOLECULAR FORMULA: C10H15N3O6
MOLECULAR WEIGHT: 273.2426
SMILES: COC(=O)/C=C/C(=O)NC[C@@H](C(=O)NCC(=O)O)N
Structure:
CAS RN: 108203-22-1
CAS Name: 3-[[(E)-2-cyanoethenyl]amino]propanenitrile
OPENEYE Name: 3-[[(E)-2-cyanovinyl]amino]propanenitrile
IUPAC Name: 3-[[(E)-2-cyanoethenyl]amino]propanenitrile
SYSTEMATIC NAME: 3-[[(E)-2-cyanoethenyl]amino]propanenitrile
MOLECULAR FORMULA: C6H7N3
MOLECULAR WEIGHT: 121.13988
SMILES: C(CN/C=C/C#N)C#N
Structure:
CAS RN: 108102-62-1
CAS Name: (2E,4E,6E)-8-[2-(2-hydroxy-3-methyl-1-oxobutoxy)-3-methyl-1-oxopentoxy]-8-(2-methyl-2-oxiranyl)octa-2,4,6-trienoic acid
OPENEYE Name: (2E,4E,6E)-8-[2-(2-hydroxy-3-methyl-butanoyl)oxy-3-methyl-pentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid
IUPAC Name: (2E,4E,6E)-8-[2-(2-hydroxy-3-methylbutanoyl)oxy-3-methylpentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid
SYSTEMATIC NAME: (2E,4E,6E)-8-[3-methyl-2-(3-methyl-2-oxidanyl-butanoyl)oxy-pentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid
MOLECULAR FORMULA: C22H32O8
MOLECULAR WEIGHT: 424.48468
SMILES: CCC(C)C(C(=O)OC(/C=C/C=C/C=C/C(=O)O)C1(CO1)C)OC(=O)C(C(C)C)O
Structure:
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