CAS RN: 94935-24-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: C/C=C(\C)/C=C/C=C/[C@H]1[C@@H]2C[C@@H]2[C@]3(N1CC[C@@H]4[C@H]3O4)O
Structure:
CAS RN: 94825-60-2
CAS Name: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid; 4-amino-5-hydroxynaphthalene-2,7-disulfonic acid; 6-amino-4-hydroxy-2-naphthalenesulfonic acid; 2-hydroxy-3-methylbenzoic acid
OPENEYE Name: 5-amino-2-[(E)-2-(4-amino-2-sulfo-phenyl)vinyl]benzenesulfonic acid; 4-amino-5-hydroxy-naphthalene-2,7-disulfonic acid; 6-amino-4-hydroxy-naphthalene-2-sulfonic acid; 2-hydroxy-3-methyl-benzoic acid
IUPAC Name: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid; 4-amino-5-hydroxynaphthalene-2,7-disulfonic acid; 6-amino-4-hydroxynaphthalene-2-sulfonic acid; 2-hydroxy-3-methylbenzoic acid
SYSTEMATIC NAME: 5-azanyl-2-[(E)-2-(4-azanyl-2-sulfo-phenyl)ethenyl]benzenesulfonic acid; 4-azanyl-5-oxidanyl-naphthalene-2,7-disulfonic acid; 6-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid; 3-methyl-2-oxidanyl-benzoic acid
MOLECULAR FORMULA: C42H40N4O20S5
MOLECULAR WEIGHT: 1081.1068
SMILES: CC1=CC=CC(=C1O)C(=O)O.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)O)N.C1=CC(=C(C=C1N)S(=O)(=O)O)/C=C/C2=C(C=C(C=C2)N)S(=O)(=O)O.C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O
Structure:
CAS RN: 94788-64-4
CAS Name: (E)-2-butenedioic acid; 2-(4-ethyl-1-piperazinyl)-4-phenylquinoline
OPENEYE Name: 2-(4-ethylpiperazin-1-yl)-4-phenyl-quinoline; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 2-(4-ethylpiperazin-1-yl)-4-phenylquinoline
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-(4-ethylpiperazin-1-yl)-4-phenyl-quinoline
MOLECULAR FORMULA: C29H31N3O8
MOLECULAR WEIGHT: 549.57174
SMILES: CCN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 94333-51-4
CAS Name: (6E)-6-ethylidene-2,2,5-trimethyl-1-cyclohexanecarboxylic acid ethyl ester
OPENEYE Name: ethyl (6E)-6-ethylidene-2,2,5-trimethyl-cyclohexanecarboxylate
IUPAC Name: ethyl (6E)-6-ethylidene-2,2,5-trimethylcyclohexane-1-carboxylate
SYSTEMATIC NAME: ethyl (6E)-6-ethylidene-2,2,5-trimethyl-cyclohexane-1-carboxylate
MOLECULAR FORMULA: C14H24O2
MOLECULAR WEIGHT: 224.33916
SMILES: CCOC(=O)C1/C(=C/C)/C(CCC1(C)C)C
Structure:
CAS RN: 94116-22-0
CAS Name: 3-[[(10E,20E)-15-[(E)-10-[[amino(methylimino)methyl]amino]-4-methyldec-4-en-2-yl]-3,5,7,9,23,25,27,31,33,34,35-undecahydroxy-8,10,14,18,22,26,30-heptamethyl-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,20-dien-19-yl]oxy]-3-oxopropanoic acid
OPENEYE Name: 3-[[(10E,20E)-15-[(E)-1,3-dimethyl-9-[(N'-methylcarbamimidoyl)amino]non-3-enyl]-3,5,7,9,23,25,27,31,33,34,35-undecahydroxy-8,10,14,18,22,26,30-heptamethyl-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,20-dien-19-yl]oxy]-3-oxo-propanoic acid
IUPAC Name: 3-oxo-3-[[(10E,20E)-3,5,7,9,23,25,27,31,33,34,35-undecahydroxy-8,10,14,18,22,26,30-heptamethyl-15-[(E)-4-methyl-10-[(N'-methylcarbamimidoyl)amino]dec-4-en-2-yl]-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,20-dien-19-yl]oxy]propanoic acid
SYSTEMATIC NAME: 3-[[(10E,20E)-8,10,14,18,22,26,30-heptamethyl-15-[(E)-4-methyl-10-[(N'-methylcarbamimidoyl)amino]dec-4-en-2-yl]-3,5,7,9,23,25,27,31,33,34,35-undecakis(oxidanyl)-17-oxidanylidene-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,20-dien-19-yl]oxy]-3-oxidanyliden
MOLECULAR FORMULA: C58H103N3O18
MOLECULAR WEIGHT: 1130.44772
SMILES: CC1CC/C=C(/C(C(C(CC(CC(CC2CC(C(C(O2)(CC(C(CCC(C(C(CC(C(/C=C/C(C(C(=O)OC1C(C)C/C(=C/CCCCCNC(=NC)N)/C)C)OC(=O)CC(=O)O)C)O)O)C)O)C)O)O)O)O)O)O)O)C)O)\C
Structure:
CAS RN: 94042-67-8
CAS Name: 1-octadecanamine; (Z)-9-octadecenoic acid
OPENEYE Name: octadecan-1-amine; (Z)-octadec-9-enoic acid
IUPAC Name: octadecan-1-amine; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: octadecan-1-amine; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C36H73NO2
MOLECULAR WEIGHT: 551.97032
SMILES: CCCCCCCCCCCCCCCCCCN.CCCCCCCC/C=C\CCCCCCCC(=O)O
Structure:
CAS RN: 94022-57-8
CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-3-[[(Z)-octadec-9-enyl]amino]propanamide
OPENEYE Name: N-[[3-(aminomethyl)phenyl]methyl]-3-[[(Z)-octadec-9-enyl]amino]propanamide
IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-3-[[(Z)-octadec-9-enyl]amino]propanamide
SYSTEMATIC NAME: N-[[3-(aminomethyl)phenyl]methyl]-3-[[(Z)-octadec-9-enyl]amino]propanamide
MOLECULAR FORMULA: C29H51N3O
MOLECULAR WEIGHT: 457.73474
SMILES: CCCCCCCC/C=C\CCCCCCCCNCCC(=O)NCC1=CC=CC(=C1)CN
Structure:
CAS RN: 93966-93-9
CAS Name: ammonia; furan-2,5-dione; (Z)-4-methoxy-4-oxo-2-butenoic acid; (Z)-4-(2-methylpropoxy)-4-oxo-2-butenoic acid; styrene
OPENEYE Name: ammonia; furan-2,5-dione; (Z)-4-isobutoxy-4-oxo-but-2-enoic acid; (Z)-4-methoxy-4-oxo-but-2-enoic acid; styrene
IUPAC Name: azane; furan-2,5-dione; (Z)-4-methoxy-4-oxobut-2-enoic acid; (Z)-4-(2-methylpropoxy)-4-oxobut-2-enoic acid; styrene
SYSTEMATIC NAME: azane; ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoic acid; (Z)-4-(2-methylpropoxy)-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C25H31NO11
MOLECULAR WEIGHT: 521.51374
SMILES: CC(C)COC(=O)/C=C\C(=O)O.COC(=O)/C=C\C(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O.N
Structure:
CAS RN: 93882-22-5
CAS Name: (Z)-2,2,8-trimethyl-3-nonen-3-ol
OPENEYE Name: (Z)-2,2,8-trimethylnon-3-en-3-ol
IUPAC Name: (Z)-2,2,8-trimethylnon-3-en-3-ol
SYSTEMATIC NAME: (Z)-2,2,8-trimethylnon-3-en-3-ol
MOLECULAR FORMULA: C12H24O
MOLECULAR WEIGHT: 184.31836
SMILES: CC(C)CCC/C=C(/C(C)(C)C)\O
Structure:
CAS RN: 93470-46-3
CAS Name: (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid
OPENEYE Name: (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid
IUPAC Name: (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid
SYSTEMATIC NAME: (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid
MOLECULAR FORMULA: C22H32O2
MOLECULAR WEIGHT: 328.48828
SMILES: CCCCCCCCC/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)O
Structure:
CAS RN: 92771-38-5
CAS Name: 4-[5-chloro-2-[(Z)-2-[(Z)-[5-chloro-3-(4-sulfobutyl)-1,3-benzoxazol-2-ylidene]methyl]but-1-enyl]-1,3-benzoxazol-3-ium-3-yl]-1-butanesulfonate; N,N-diethylethanamine
OPENEYE Name: 4-[5-chloro-2-[(Z)-2-[(Z)-[5-chloro-3-(4-sulfobutyl)-1,3-benzoxazol-2-ylidene]methyl]but-1-enyl]-1,3-benzoxazol-3-ium-3-yl]butane-1-sulfonate; N,N-diethylethanamine
IUPAC Name: 4-[5-chloro-2-[(Z)-2-[(Z)-[5-chloro-3-(4-sulfobutyl)-1,3-benzoxazol-2-ylidene]methyl]but-1-enyl]-1,3-benzoxazol-3-ium-3-yl]butane-1-sulfonate; N,N-diethylethanamine
SYSTEMATIC NAME: 4-[5-chloranyl-2-[(Z)-2-[(Z)-[5-chloranyl-3-(4-sulfobutyl)-1,3-benzoxazol-2-ylidene]methyl]but-1-enyl]-1,3-benzoxazol-3-ium-3-yl]butane-1-sulfonate; N,N-diethylethanamine
MOLECULAR FORMULA: C33H45Cl2N3O8S2
MOLECULAR WEIGHT: 746.7617
SMILES: CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCCS(=O)(=O)[O-])/C=C\3/N(C4=C(O3)C=CC(=C4)Cl)CCCCS(=O)(=O)O.CCN(CC)CC
Structure:
CAS RN: 73545-19-4
CAS Name: (Z)-1,1-diethoxy-4-decene
OPENEYE Name: (Z)-1,1-diethoxydec-4-ene
IUPAC Name: (Z)-1,1-diethoxydec-4-ene
SYSTEMATIC NAME: (Z)-1,1-diethoxydec-4-ene
MOLECULAR FORMULA: C14H28O2
MOLECULAR WEIGHT: 228.37092
SMILES: CCCCC/C=C\CCC(OCC)OCC
Structure:
CAS RN: 73537-10-7
CAS Name: (E)-8-[7-hydroxy-3-[3-(6-hydroxy-3,5,6-trimethyl-2-oxanyl)-7-[(5-methoxy-6-methyl-2-oxanyl)oxy]-1,6-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxo-6-nonenoic acid
OPENEYE Name: (E)-8-[7-hydroxy-3-[3-(6-hydroxy-3,5,6-trimethyl-tetrahydropyran-2-yl)-7-(5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-1,6-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxo-non-6-enoic acid
IUPAC Name: (E)-8-[7-hydroxy-3-[3-(6-hydroxy-3,5,6-trimethyloxan-2-yl)-7-(5-methoxy-6-methyloxan-2-yl)oxy-1,6-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid
SYSTEMATIC NAME: (E)-8-[3-[7-(5-methoxy-6-methyl-oxan-2-yl)oxy-1,6-dimethyl-3-(3,5,6-trimethyl-6-oxidanyl-oxan-2-yl)-4,10-dioxaspiro[4.5]decan-9-yl]-3,8-dimethyl-7-oxidanyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxidanylidene-non-6-enoic acid
MOLECULAR FORMULA: C47H78O13
MOLECULAR WEIGHT: 851.11442
SMILES: CC1CC(C(OC1C2CC(C3(O2)C(C(CC(O3)C4(CCC5(O4)CC(C(C(O5)C(C)/C=C(\C)/C(=O)C(C)CC(C)C(=O)O)C)O)C)OC6CCC(C(O6)C)OC)C)C)(C)O)C
Structure:
CAS RN: 73398-81-9
CAS Name: trisodium 2-[3-sulfonato-4-[(E)-2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)azo]phenyl]ethenyl]phenyl]-5-benzo[e]benzotriazolesulfonate
OPENEYE Name: trisodium 2-[3-sulfonato-4-[(E)-2-[2-sulfonato-4-(2,4,6-trioxohexahydropyrimidin-5-yl)azo-phenyl]vinyl]phenyl]benzo[e]benzotriazole-5-sulfonate
IUPAC Name: trisodium 2-[3-sulfonato-4-[(E)-2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
SYSTEMATIC NAME: trisodium 2-[3-sulfonato-4-[(E)-2-[2-sulfonato-4-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
MOLECULAR FORMULA: C28H16N7Na3O12S3
MOLECULAR WEIGHT: 807.63065
SMILES: C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)N=NC6C(=O)NC(=O)NC6=O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
Structure:
CAS RN: 73385-60-1
CAS Name: (2S)-1-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-4-methylsulfinyl-1-oxobutyl]amino]-1-oxoethyl]amino]-3-(4-nitrophenyl)-1-oxopropyl]-2-pyrrolidinecarboxamide
OPENEYE Name: (2S)-1-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfinyl-butanoyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
IUPAC Name: (2S)-1-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfinylbutanoyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfinyl-butanoyl]amino]ethanoylamino]-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C30H39N7O9S
MOLECULAR WEIGHT: 673.73716
SMILES: CS(=O)CC[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N2CCC[C@H]2C(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)N
Structure:
CAS RN: 73027-06-2
CAS Name: (E)-4-[4-[bis(2-chloroethyl)amino]phenyl]-3-butenoic acid
OPENEYE Name: (E)-4-[4-[bis(2-chloroethyl)amino]phenyl]but-3-enoic acid
IUPAC Name: (E)-4-[4-[bis(2-chloroethyl)amino]phenyl]but-3-enoic acid
SYSTEMATIC NAME: (E)-4-[4-[bis(2-chloroethyl)amino]phenyl]but-3-enoic acid
MOLECULAR FORMULA: C14H17Cl2NO2
MOLECULAR WEIGHT: 302.19628
SMILES: C1=CC(=CC=C1/C=C/CC(=O)O)N(CCCl)CCCl
Structure:
CAS RN: 73019-24-6
CAS Name: N-[5-[[(E)-3-chloroprop-2-enyl]-(2-cyanoethyl)amino]-2-[(4-cyano-3-methyl-5-isothiazolyl)azo]phenyl]acetamide
OPENEYE Name: N-[5-[[(E)-3-chloroallyl]-(2-cyanoethyl)amino]-2-(4-cyano-3-methyl-isothiazol-5-yl)azo-phenyl]acetamide
IUPAC Name: N-[5-[[(E)-3-chloroprop-2-enyl]-(2-cyanoethyl)amino]-2-[(4-cyano-3-methyl-1,2-thiazol-5-yl)diazenyl]phenyl]acetamide
SYSTEMATIC NAME: N-[5-[[(E)-3-chloranylprop-2-enyl]-(2-cyanoethyl)amino]-2-[(4-cyano-3-methyl-1,2-thiazol-5-yl)diazenyl]phenyl]ethanamide
MOLECULAR FORMULA: C19H18ClN7OS
MOLECULAR WEIGHT: 427.91052
SMILES: CC1=NSC(=C1C#N)N=NC2=C(C=C(C=C2)N(CCC#N)C/C=C/Cl)NC(=O)C
Structure:
CAS RN: 72939-53-8
CAS Name: (2E)-2-(2-hydroxy-2-methylpropylidene)-1-cyclohex-3-enecarboxaldehyde
OPENEYE Name: (2E)-2-(2-hydroxy-2-methyl-propylidene)cyclohex-3-ene-1-carbaldehyde
IUPAC Name: (2E)-2-(2-hydroxy-2-methylpropylidene)cyclohex-3-ene-1-carbaldehyde
SYSTEMATIC NAME: (2E)-2-(2-methyl-2-oxidanyl-propylidene)cyclohex-3-ene-1-carbaldehyde
MOLECULAR FORMULA: C11H16O2
MOLECULAR WEIGHT: 180.24354
SMILES: CC(C)(/C=C/1\C=CCCC1C=O)O
Structure:
CAS RN: 72929-01-2
CAS Name: formaldehyde; 5-[(E)-prop-1-enyl]-1,3-benzodioxole
OPENEYE Name: formaldehyde; 5-[(E)-prop-1-enyl]-1,3-benzodioxole
IUPAC Name: formaldehyde; 5-[(E)-prop-1-enyl]-1,3-benzodioxole
SYSTEMATIC NAME: methanal; 5-[(E)-prop-1-enyl]-1,3-benzodioxole
MOLECULAR FORMULA: C11H12O3
MOLECULAR WEIGHT: 192.21118
SMILES: C/C=C/C1=CC2=C(C=C1)OCO2.C=O
Structure:
CAS RN: 72928-53-1
CAS Name: (2Z)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
OPENEYE Name: (2Z)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethyl-octa-2,6-diene
IUPAC Name: (2Z)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
SYSTEMATIC NAME: (2Z)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethyl-octa-2,6-diene
MOLECULAR FORMULA: C20H34O
MOLECULAR WEIGHT: 290.48336
SMILES: CC(=CCC/C(=C/COC/C=C(/C)\CCC=C(C)C)/C)C
Structure:
CAS RN: 72928-47-3
CAS Name: (2E,4E)-4-ethylocta-2,4-dienoic acid
OPENEYE Name: (2E,4E)-4-ethylocta-2,4-dienoic acid
IUPAC Name: (2E,4E)-4-ethylocta-2,4-dienoic acid
SYSTEMATIC NAME: (2E,4E)-4-ethylocta-2,4-dienoic acid
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CCC/C=C(\CC)/C=C/C(=O)O
Structure:
CAS RN: 72928-34-8
CAS Name: (E)-2-hexenoic acid 3-methylbutyl ester
OPENEYE Name: isopentyl (E)-hex-2-enoate
IUPAC Name: 3-methylbutyl (E)-hex-2-enoate
SYSTEMATIC NAME: 3-methylbutyl (E)-hex-2-enoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCC/C=C/C(=O)OCCC(C)C
Structure:
CAS RN: 72928-27-9
CAS Name: (4E)-4,8-dimethyl-1-deca-4,9-dienol
OPENEYE Name: (4E)-4,8-dimethyldeca-4,9-dien-1-ol
IUPAC Name: (4E)-4,8-dimethyldeca-4,9-dien-1-ol
SYSTEMATIC NAME: (4E)-4,8-dimethyldeca-4,9-dien-1-ol
MOLECULAR FORMULA: C12H22O
MOLECULAR WEIGHT: 182.30248
SMILES: CC(CC/C=C(\C)/CCCO)C=C
Structure:
CAS RN: 72928-07-5
CAS Name: (Z)-3-(3-bicyclo[2.2.1]heptanyl)-2-butenenitrile
OPENEYE Name: (Z)-3-norbornan-2-ylbut-2-enenitrile
IUPAC Name: (Z)-3-(3-bicyclo[2.2.1]heptanyl)but-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(3-bicyclo[2.2.1]heptanyl)but-2-enenitrile
MOLECULAR FORMULA: C11H15N
MOLECULAR WEIGHT: 161.2435
SMILES: C/C(=C/C#N)/C1CC2CCC1C2
Structure:
CAS RN: 72928-00-8
CAS Name: (4E)-2,4,8-trimethyldeca-4,9-dienal
OPENEYE Name: (4E)-2,4,8-trimethyldeca-4,9-dienal
IUPAC Name: (4E)-2,4,8-trimethyldeca-4,9-dienal
SYSTEMATIC NAME: (4E)-2,4,8-trimethyldeca-4,9-dienal
MOLECULAR FORMULA: C13H22O
MOLECULAR WEIGHT: 194.31318
SMILES: CC(CC/C=C(\C)/CC(C)C=O)C=C
Structure:
CAS RN: 72927-97-0
CAS Name: (5E)-5-(2-hydroxy-2-methylpropylidene)-1-cyclohex-3-enecarboxaldehyde
OPENEYE Name: (5E)-5-(2-hydroxy-2-methyl-propylidene)cyclohex-3-ene-1-carbaldehyde
IUPAC Name: (5E)-5-(2-hydroxy-2-methylpropylidene)cyclohex-3-ene-1-carbaldehyde
SYSTEMATIC NAME: (5E)-5-(2-methyl-2-oxidanyl-propylidene)cyclohex-3-ene-1-carbaldehyde
MOLECULAR FORMULA: C11H16O2
MOLECULAR WEIGHT: 180.24354
SMILES: CC(C)(/C=C/1\CC(CC=C1)C=O)O
Structure:
CAS RN: 72927-81-2
CAS Name: (2E)-3,7-dimethyl-1-(methylthio)octa-2,6-diene
OPENEYE Name: (2E)-3,7-dimethyl-1-methylsulfanyl-octa-2,6-diene
IUPAC Name: (2E)-3,7-dimethyl-1-methylsulfanylocta-2,6-diene
SYSTEMATIC NAME: (2E)-3,7-dimethyl-1-methylsulfanyl-octa-2,6-diene
MOLECULAR FORMULA: C11H20S
MOLECULAR WEIGHT: 184.3415
SMILES: CC(=CCC/C(=C/CSC)/C)C
Structure:
CAS RN: 72901-31-6
CAS Name: (Z)-N-[(E)-octadec-9-enyl]-9-octadecenamide
OPENEYE Name: (Z)-N-[(E)-octadec-9-enyl]octadec-9-enamide
IUPAC Name: (Z)-N-[(E)-octadec-9-enyl]octadec-9-enamide
SYSTEMATIC NAME: (Z)-N-[(E)-octadec-9-enyl]octadec-9-enamide
MOLECULAR FORMULA: C36H69NO
MOLECULAR WEIGHT: 531.93916
SMILES: CCCCCCCC/C=C/CCCCCCCCNC(=O)CCCCCCC/C=C\CCCCCCCC
Structure:
CAS RN: 72894-08-7
CAS Name: (2Z)-3,7-dimethyl-1-(methylthio)octa-2,6-diene
OPENEYE Name: (2Z)-3,7-dimethyl-1-methylsulfanyl-octa-2,6-diene
IUPAC Name: (2Z)-3,7-dimethyl-1-methylsulfanylocta-2,6-diene
SYSTEMATIC NAME: (2Z)-3,7-dimethyl-1-methylsulfanyl-octa-2,6-diene
MOLECULAR FORMULA: C11H20S
MOLECULAR WEIGHT: 184.3415
SMILES: CC(=CCC/C(=C\CSC)/C)C
Structure:
CAS RN: 72845-38-6
CAS Name: propanoic acid [(E)-3-methylpent-3-enyl] ester
OPENEYE Name: [(E)-3-methylpent-3-enyl] propanoate
IUPAC Name: [(E)-3-methylpent-3-enyl] propanoate
SYSTEMATIC NAME: [(E)-3-methylpent-3-enyl] propanoate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCC(=O)OCC/C(=C/C)/C
Structure:
CAS RN: 72845-36-4
CAS Name: benzoic acid [(E)-3-methylpent-3-enyl] ester
OPENEYE Name: [(E)-3-methylpent-3-enyl] benzoate
IUPAC Name: [(E)-3-methylpent-3-enyl] benzoate
SYSTEMATIC NAME: [(E)-3-methylpent-3-enyl] benzoate
MOLECULAR FORMULA: C13H16O2
MOLECULAR WEIGHT: 204.26494
SMILES: C/C=C(\C)/CCOC(=O)C1=CC=CC=C1
Structure:
CAS RN: 72814-85-8
CAS Name: 2-[(E)-2-[4-[4-[(E)-2-(2,5-dimethylphenyl)ethenyl]phenyl]phenyl]ethenyl]-1,4-dimethylbenzene
OPENEYE Name: 2-[(E)-2-[4-[4-[(E)-2-(2,5-dimethylphenyl)vinyl]phenyl]phenyl]vinyl]-1,4-dimethyl-benzene
IUPAC Name: 2-[(E)-2-[4-[4-[(E)-2-(2,5-dimethylphenyl)ethenyl]phenyl]phenyl]ethenyl]-1,4-dimethylbenzene
SYSTEMATIC NAME: 2-[(E)-2-[4-[4-[(E)-2-(2,5-dimethylphenyl)ethenyl]phenyl]phenyl]ethenyl]-1,4-dimethyl-benzene
MOLECULAR FORMULA: C32H30
MOLECULAR WEIGHT: 414.5806
SMILES: CC1=CC(=C(C=C1)C)/C=C/C2=CC=C(C=C2)C3=CC=C(C=C3)/C=C/C4=C(C=CC(=C4)C)C
Structure:
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