CAS RN: 131553-53-2
CAS Name: (Z)-4-oxo-2-penten-2-olate; zirconium(4+)
OPENEYE Name: (Z)-4-oxopent-2-en-2-olate; zirconium(4+)
IUPAC Name: (Z)-4-oxopent-2-en-2-olate; zirconium(4+)
SYSTEMATIC NAME: (Z)-4-oxidanylidenepent-2-en-2-olate; zirconium(4+)
MOLECULAR FORMULA: C20H28O8Zr
MOLECULAR WEIGHT: 487.65552
SMILES: C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Zr+4]
Structure:
CAS RN: 65137-05-5
CAS Name: (Z)-4-oxo-2-penten-2-olate; zirconium(4+)
OPENEYE Name: (Z)-4-oxopent-2-en-2-olate; zirconium(4+)
IUPAC Name: (Z)-4-oxopent-2-en-2-olate; zirconium(4+)
SYSTEMATIC NAME: (Z)-4-oxidanylidenepent-2-en-2-olate; zirconium(4+)
MOLECULAR FORMULA: C20H28O8Zr
MOLECULAR WEIGHT: 487.65552
SMILES: C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Zr+4]
Structure:
CAS RN: 129712-19-2
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 133049-67-9
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 1337-23-1
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 147335-61-3
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 158853-82-8
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 162628-82-2
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 37226-44-1
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 37291-22-8
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 37325-22-7
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 37380-76-0
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 54018-84-7
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 73243-58-0
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 88529-26-4
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 9014-90-8
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 9021-88-9
CAS Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
OPENEYE Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
IUPAC Name: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
SYSTEMATIC NAME: sodium 1-nonyl-2-(2-nonylphenoxy)benzene sulfate
MOLECULAR FORMULA: C30H46NaO5S-
MOLECULAR WEIGHT: 541.73801
SMILES: CCCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 7786-47-2
CAS Name: 3-methylbutanoic acid nonyl ester
OPENEYE Name: nonyl 3-methylbutanoate
IUPAC Name: nonyl 3-methylbutanoate
SYSTEMATIC NAME: nonyl 3-methylbutanoate
MOLECULAR FORMULA: C14H28O2
MOLECULAR WEIGHT: 228.37092
SMILES: CCCCCCCCCOC(=O)CC(C)C
Structure:
CAS RN: 7784-98-7
CAS Name: (E)-1-(2,6,6-trimethyl-1-cyclohex-3-enyl)-1-penten-3-one
OPENEYE Name: (E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one
IUPAC Name: (E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one
SYSTEMATIC NAME: (E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one
MOLECULAR FORMULA: C14H22O
MOLECULAR WEIGHT: 206.32388
SMILES: CCC(=O)/C=C/C1C(C=CCC1(C)C)C
Structure:
CAS RN: 7779-94-4
CAS Name: 8,8-diethoxy-2,6-dimethyl-2-octanol
OPENEYE Name: 8,8-diethoxy-2,6-dimethyl-octan-2-ol
IUPAC Name: 8,8-diethoxy-2,6-dimethyloctan-2-ol
SYSTEMATIC NAME: 8,8-diethoxy-2,6-dimethyl-octan-2-ol
MOLECULAR FORMULA: C14H30O3
MOLECULAR WEIGHT: 246.3862
SMILES: CCOC(CC(C)CCCC(C)(C)O)OCC
Structure:
CAS RN: 7779-07-9
CAS Name: 2,6-dimethyloctanal
OPENEYE Name: 2,6-dimethyloctanal
IUPAC Name: 2,6-dimethyloctanal
SYSTEMATIC NAME: 2,6-dimethyloctanal
MOLECULAR FORMULA: C10H20O
MOLECULAR WEIGHT: 156.2652
SMILES: CCC(C)CCCC(C)C=O
Structure:
CAS RN: 7774-96-1
CAS Name: formic acid [2-methoxy-4-[(E)-prop-1-enyl]phenyl] ester
OPENEYE Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] formate
IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] formate
SYSTEMATIC NAME: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] methanoate
MOLECULAR FORMULA: C11H12O3
MOLECULAR WEIGHT: 192.21118
SMILES: C/C=C/C1=CC(=C(C=C1)OC=O)OC
Structure:
CAS RN: 7774-79-0
CAS Name: 4-(4-methylphenyl)-2-butanone
OPENEYE Name: 4-(p-tolyl)butan-2-one
IUPAC Name: 4-(4-methylphenyl)butan-2-one
SYSTEMATIC NAME: 4-(4-methylphenyl)butan-2-one
MOLECULAR FORMULA: C11H14O
MOLECULAR WEIGHT: 162.22826
SMILES: CC1=CC=C(C=C1)CCC(=O)C
Structure:
CAS RN: 7732-92-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H23NO3
MOLECULAR WEIGHT: 301.38012
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](CC4)OC
Structure:
CAS RN: 7492-45-7
CAS Name: (E)-2-decenoic acid butyl ester
OPENEYE Name: butyl (E)-dec-2-enoate
IUPAC Name: butyl (E)-dec-2-enoate
SYSTEMATIC NAME: butyl (E)-dec-2-enoate
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: CCCCCCC/C=C/C(=O)OCCCC
Structure:
CAS RN: 7492-37-7
CAS Name: 3-(phenylmethyl)-4-heptanone
OPENEYE Name: 3-benzylheptan-4-one
IUPAC Name: 3-benzylheptan-4-one
SYSTEMATIC NAME: 3-(phenylmethyl)heptan-4-one
MOLECULAR FORMULA: C14H20O
MOLECULAR WEIGHT: 204.308
SMILES: CCCC(=O)C(CC)CC1=CC=CC=C1
Structure:
CAS RN: 7367-88-6
CAS Name: (E)-2-decenoic acid ethyl ester
OPENEYE Name: ethyl (E)-dec-2-enoate
IUPAC Name: ethyl (E)-dec-2-enoate
SYSTEMATIC NAME: ethyl (E)-dec-2-enoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CCCCCCC/C=C/C(=O)OCC
Structure:
CAS RN: 7179-50-2
CAS Name: calcium (5S,5aR,6S,6aR,7S,9Z,10aS)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-5,6,10a-trihydroxy-5-methyl-8,10,11-trioxo-5a,6,6a,7-tetrahydrotetracene-1,12-diolate
OPENEYE Name: calcium (5S,5aR,6S,6aR,7S,9Z,10aS)-9-[amino(hydroxy)methylene]-7-(dimethylamino)-5,6,10a-trihydroxy-5-methyl-8,10,11-trioxo-5a,6,6a,7-tetrahydrotetracene-1,12-diolate
IUPAC Name: calcium (5S,5aR,6S,6aR,7S,9Z,10aS)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-5,6,10a-trihydroxy-5-methyl-8,10,11-trioxo-5a,6,6a,7-tetrahydrotetracene-1,12-diolate
SYSTEMATIC NAME: calcium (5S,5aR,6S,6aR,7S,9Z,10aS)-9-[azanyl(oxidanyl)methylidene]-7-(dimethylamino)-5-methyl-5,6,10a-tris(oxidanyl)-8,10,11-tris(oxidanylidene)-5a,6,6a,7-tetrahydrotetracene-1,12-diolate
MOLECULAR FORMULA: C22H22CaN2O9
MOLECULAR WEIGHT: 498.49608
SMILES: C[C@@]1([C@H]2[C@@H]([C@H]3[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]3(C(=O)C2=C(C4=C1C=CC=C4[O-])[O-])O)N(C)C)O)O.[Ca+2]
Structure:
CAS RN: 16970-46-0
CAS Name: iron; octanoate
OPENEYE Name: iron; octanoate
IUPAC Name: iron; octanoate
SYSTEMATIC NAME: iron; octanoate
MOLECULAR FORMULA: C8H15FeO2-
MOLECULAR WEIGHT: 199.0485
SMILES: CCCCCCCC(=O)[O-].[Fe]
Structure:
CAS RN: 620966-43-0
CAS Name: iron; octanoate
OPENEYE Name: iron; octanoate
IUPAC Name: iron; octanoate
SYSTEMATIC NAME: iron; octanoate
MOLECULAR FORMULA: C8H15FeO2-
MOLECULAR WEIGHT: 199.0485
SMILES: CCCCCCCC(=O)[O-].[Fe]
Structure:
CAS RN: 6535-20-2
CAS Name: iron; octanoate
OPENEYE Name: iron; octanoate
IUPAC Name: iron; octanoate
SYSTEMATIC NAME: iron; octanoate
MOLECULAR FORMULA: C8H15FeO2-
MOLECULAR WEIGHT: 199.0485
SMILES: CCCCCCCC(=O)[O-].[Fe]
Structure:
CAS RN: 600-26-0
CAS Name: 1-nitroethanone oxime
OPENEYE Name: 1-nitroethanone oxime
IUPAC Name: (NZ)-N-(1-nitroethylidene)hydroxylamine
SYSTEMATIC NAME: (NZ)-N-(1-nitroethylidene)hydroxylamine
MOLECULAR FORMULA: C2H4N2O3
MOLECULAR WEIGHT: 104.06476
SMILES: C/C(=N/O)/[N+](=O)[O-]
Structure:
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