CAS RN: 58493-48-4
CAS Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-methyl-7-decenamide
OPENEYE Name: (E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-9-methyl-dec-7-enamide
IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-methyldec-7-enamide
SYSTEMATIC NAME: (E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-9-methyl-dec-7-enamide
MOLECULAR FORMULA: C19H29NO3
MOLECULAR WEIGHT: 319.43846
SMILES: CC(C)/C=C/CCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 58207-70-8
CAS Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chloroethenyl]-2,4-dimethylcyclohexene
OPENEYE Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chlorovinyl]-2,4-dimethyl-cyclohexene
IUPAC Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chloroethenyl]-2,4-dimethylcyclohexene
SYSTEMATIC NAME: (4R,5S)-4,5-bis(chloranyl)-1-[(E)-2-chloranylethenyl]-2,4-dimethyl-cyclohexene
MOLECULAR FORMULA: C10H13Cl3
MOLECULAR WEIGHT: 239.56922
SMILES: CC1=C(C[C@@H]([C@](C1)(C)Cl)Cl)/C=C/Cl
Structure:
CAS RN: 57566-89-9
CAS Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chloroethenyl]-2,4-dimethylcyclohexene
OPENEYE Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chlorovinyl]-2,4-dimethyl-cyclohexene
IUPAC Name: (4R,5S)-4,5-dichloro-1-[(E)-2-chloroethenyl]-2,4-dimethylcyclohexene
SYSTEMATIC NAME: (4R,5S)-4,5-bis(chloranyl)-1-[(E)-2-chloranylethenyl]-2,4-dimethyl-cyclohexene
MOLECULAR FORMULA: C10H13Cl3
MOLECULAR WEIGHT: 239.56922
SMILES: CC1=C(C[C@@H]([C@](C1)(C)Cl)Cl)/C=C/Cl
Structure:
CAS RN: 57918-91-9
CAS Name: (E)-4-(4-methoxyphenyl)-2-methyl-3-buten-2-ol
OPENEYE Name: (E)-4-(4-methoxyphenyl)-2-methyl-but-3-en-2-ol
IUPAC Name: (E)-4-(4-methoxyphenyl)-2-methylbut-3-en-2-ol
SYSTEMATIC NAME: (E)-4-(4-methoxyphenyl)-2-methyl-but-3-en-2-ol
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: CC(C)(/C=C/C1=CC=C(C=C1)OC)O
Structure:
CAS RN: 57499-02-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H28N2O5
MOLECULAR WEIGHT: 412.47882
SMILES: C/C=C\1/CN2[C@H]3C[C@H]1C(C45C3(N(C6=CC(=C(C=C64)OC)OC)C)O[C@@H]2C5)C(=O)OC
Structure:
CAS RN: 42483-56-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H44O6
MOLECULAR WEIGHT: 548.70956
SMILES: CCC/C=C/C=C/C=C/C=C/C=C/C(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)CO)O)O)C
Structure:
CAS RN: 37294-05-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H42O15
MOLECULAR WEIGHT: 678.67758
SMILES: C/C=C(\C)/C(=O)O[C@H]1C[C@H]([C@]2(CO[C@H]3[C@@H]2C14CO[C@@]([C@H]4[C@]([C@@H]3O)(C)[C@@]56C7C[C@@H]([C@@]5(O6)C)[C@]8(C=CO[C@H]8O7)O)(C(=O)OC)O)C(=O)OC)O
Structure:
CAS RN: 36700-45-5
CAS Name: (E)-1-(4-hydroxy-3-methoxyphenyl)-4-dodecen-3-one
OPENEYE Name: (E)-1-(4-hydroxy-3-methoxy-phenyl)dodec-4-en-3-one
IUPAC Name: (E)-1-(4-hydroxy-3-methoxyphenyl)dodec-4-en-3-one
SYSTEMATIC NAME: (E)-1-(3-methoxy-4-oxidanyl-phenyl)dodec-4-en-3-one
MOLECULAR FORMULA: C19H28O3
MOLECULAR WEIGHT: 304.42382
SMILES: CCCCCCC/C=C/C(=O)CCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 34429-54-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H32NO9+
MOLECULAR WEIGHT: 466.50148
SMILES: C/C=C\1/C(C(C(C(=O)OCC2=CC[N+]3(C2(C(CC3)OC1=O)O)C)(C)OC(=O)C)C)OC(=O)C
Structure:
CAS RN: 31152-46-2
CAS Name: (Z)-2-tetracosenoic acid
OPENEYE Name: (Z)-tetracos-2-enoic acid
IUPAC Name: (Z)-tetracos-2-enoic acid
SYSTEMATIC NAME: (Z)-tetracos-2-enoic acid
MOLECULAR FORMULA: C24H46O2
MOLECULAR WEIGHT: 366.62084
SMILES: CCCCCCCCCCCCCCCCCCCCC/C=C\C(=O)O
Structure:
CAS RN: 28463-23-2
CAS Name: sulfuric acid [[(E)-5-(methylthio)-1-oxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-mercapto-2-oxanyl]pent-4-enyl]amino] ester
OPENEYE Name: [[(E)-5-methylsulfanyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-sulfanyl-tetrahydropyran-2-yl]pent-4-enoyl]amino] hydrogen sulfate
IUPAC Name: [[(E)-5-methylsulfanyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-sulfanyloxan-2-yl]pent-4-enoyl]amino] hydrogen sulfate
SYSTEMATIC NAME: [[(E)-2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)-2-sulfanyl-oxan-2-yl]-5-methylsulfanyl-pent-4-enoyl]amino] hydrogen sulfate
MOLECULAR FORMULA: C12H21NO10S3
MOLECULAR WEIGHT: 435.49084
SMILES: CS/C=C/CC(C(=O)NOS(=O)(=O)O)[C@@]1([C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)S
Structure:
CAS RN: 27773-86-0
CAS Name: (Z)-2-methyl-2-butenoic acid [(7R,8R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl ester
OPENEYE Name: [(7R,8R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl (Z)-2-methylbut-2-enoate
IUPAC Name: [(7R,8R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl (Z)-2-methylbut-2-enoate
SYSTEMATIC NAME: [(7R,8R)-4-oxidanidyl-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl (Z)-2-methylbut-2-enoate
MOLECULAR FORMULA: C13H19NO4
MOLECULAR WEIGHT: 253.29426
SMILES: C/C=C(/C)\C(=O)OCC1=CC[N+]2([C@H]1[C@@H](CC2)O)[O-]
Structure:
CAS RN: 26531-71-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H52O3
MOLECULAR WEIGHT: 484.75348
SMILES: C[C@H](C/C=C/C(C)(C)O)[C@H]1CC[C@@]2([C@@]1(CCC34[C@H]2CCC5C3(C4)CC[C@@H](C5(C)C)OC(=O)C)C)C
Structure:
CAS RN: 19941-83-4
CAS Name: (E)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-2-penten-1-ol
OPENEYE Name: (E)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-pent-2-en-1-ol
IUPAC Name: (E)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-pent-2-en-1-ol
MOLECULAR FORMULA: C20H34O
MOLECULAR WEIGHT: 290.48336
SMILES: C[C@@H]1CC[C@@]2([C@@H]([C@@]1(C)CC/C(=C/CO)/C)CCC=C2C)C
Structure:
CAS RN: 101977-26-8
CAS Name: (2S,3S,4S)-4-[(2Z,4Z,6R)-6-carboxyhepta-2,4-dien-2-yl]-3-(carboxymethyl)-2-pyrrolidinecarboxylic acid
OPENEYE Name: (2S,3S,4S)-3-(carboxymethyl)-4-[(1Z,3Z,5R)-5-carboxy-1-methyl-hexa-1,3-dienyl]pyrrolidine-2-carboxylic acid
IUPAC Name: (2S,3S,4S)-4-[(2Z,4Z,6R)-6-carboxyhepta-2,4-dien-2-yl]-3-(carboxymethyl)pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S)-3-(2-hydroxy-2-oxoethyl)-4-[(2Z,4Z,6R)-6-methyl-7-oxidanyl-7-oxidanylidene-hepta-2,4-dien-2-yl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C15H21NO6
MOLECULAR WEIGHT: 311.33034
SMILES: C[C@H](/C=C\C=C(\C)/[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O)C(=O)O
Structure:
CAS RN: 101977-25-7
CAS Name: (2S,3S,4S)-4-[(2E,5E)-6-carboxyhepta-2,5-dien-2-yl]-3-(carboxymethyl)-2-pyrrolidinecarboxylic acid
OPENEYE Name: (2S,3S,4S)-3-(carboxymethyl)-4-[(1E,4E)-5-carboxy-1-methyl-hexa-1,4-dienyl]pyrrolidine-2-carboxylic acid
IUPAC Name: (2S,3S,4S)-4-[(2E,5E)-6-carboxyhepta-2,5-dien-2-yl]-3-(carboxymethyl)pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S)-3-(2-hydroxy-2-oxoethyl)-4-[(2E,5E)-6-methyl-7-oxidanyl-7-oxidanylidene-hepta-2,5-dien-2-yl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C15H21NO6
MOLECULAR WEIGHT: 311.33034
SMILES: C/C(=C\C/C=C(\C)/C(=O)O)/[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O
Structure:
CAS RN: 101976-96-9
CAS Name: (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]-2-pentenoic acid methyl ester
OPENEYE Name: methyl (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
IUPAC Name: methyl (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
SYSTEMATIC NAME: methyl (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
MOLECULAR FORMULA: C19H25BrO3
MOLECULAR WEIGHT: 381.304
SMILES: COC(=O)/C=C/CC[C@H]1CCCC[C@@H]1OCC2=CC=C(C=C2)Br
Structure:
CAS RN: 101976-95-8
CAS Name: (Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-penten-1-ol
OPENEYE Name: (Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
IUPAC Name: (Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C17H34O2Si
MOLECULAR WEIGHT: 298.53616
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1CC/C=C\CO
Structure:
CAS RN: 101976-94-7
CAS Name: (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]-2-pentenoic acid methyl ester
OPENEYE Name: methyl (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
IUPAC Name: methyl (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
SYSTEMATIC NAME: methyl (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
MOLECULAR FORMULA: C25H28Cl2O3
MOLECULAR WEIGHT: 447.39402
SMILES: COC(=O)/C=C/CC[C@@H]1CCCC[C@H]1OC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 101976-93-6
CAS Name: (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-pentenoic acid methyl ester
OPENEYE Name: methyl (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enoate
IUPAC Name: methyl (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enoate
SYSTEMATIC NAME: methyl (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enoate
MOLECULAR FORMULA: C18H34O3Si
MOLECULAR WEIGHT: 326.54626
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1CC/C=C/C(=O)OC
Structure:
CAS RN: 101976-92-5
CAS Name: (E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-butenoic acid methyl ester
OPENEYE Name: methyl (E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]but-2-enoate
IUPAC Name: methyl (E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]but-2-enoate
SYSTEMATIC NAME: methyl (E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]but-2-enoate
MOLECULAR FORMULA: C17H32O3Si
MOLECULAR WEIGHT: 312.51968
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1C/C=C/C(=O)OC
Structure:
CAS RN: 101859-01-2
CAS Name: 2,4-dichlorobenzoic acid [(E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxymethoxy]cyclohexyl]pent-2-enyl] ester
OPENEYE Name: [(E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxymethoxy]cyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
IUPAC Name: [(E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxymethoxy]cyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
SYSTEMATIC NAME: [(E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxymethoxy]cyclohexyl]pent-2-enyl] 2,4-bis(chloranyl)benzoate
MOLECULAR FORMULA: C26H29BrCl2O4
MOLECULAR WEIGHT: 556.31606
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/COC(=O)C2=C(C=C(C=C2)Cl)Cl)OCOCC3=CC=C(C=C3)Br
Structure:
CAS RN: 101858-98-4
CAS Name: 2,4-dichlorobenzoic acid [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] ester
OPENEYE Name: [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
IUPAC Name: [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
SYSTEMATIC NAME: [(Z)-5-[(1R,2S)-2-oxidanylcyclohexyl]pent-2-enyl] 2,4-bis(chloranyl)benzoate
MOLECULAR FORMULA: C18H22Cl2O3
MOLECULAR WEIGHT: 357.27148
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C\COC(=O)C2=C(C=C(C=C2)Cl)Cl)O
Structure:
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