CAS RN: 12053-66-6
CAS Name: 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride
OPENEYE Name: 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride
IUPAC Name: 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride
SYSTEMATIC NAME: 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride
MOLECULAR FORMULA: C16H18ClNO3
MOLECULAR WEIGHT: 307.77202
SMILES: C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O.Cl
Structure:
CAS RN: 11034-94-9
CAS Name: 2-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-6-hydroxy-5-methoxy-9-phenyl-1-phenalenone
OPENEYE Name: 2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6-hydroxy-5-methoxy-9-phenyl-phenalen-1-one
IUPAC Name: 2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-hydroxy-5-methoxy-9-phenylphenalen-1-one
SYSTEMATIC NAME: 2-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-5-methoxy-6-oxidanyl-9-phenyl-phenalen-1-one
MOLECULAR FORMULA: C32H34O14
MOLECULAR WEIGHT: 642.60396
SMILES: COC1=C(C2=C3C(=C1)C=C(C(=O)C3=C(C=C2)C4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O
Structure:
CAS RN: 20559-12-0
CAS Name: 2-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-6-hydroxy-5-methoxy-9-phenyl-1-phenalenone
OPENEYE Name: 2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6-hydroxy-5-methoxy-9-phenyl-phenalen-1-one
IUPAC Name: 2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-hydroxy-5-methoxy-9-phenylphenalen-1-one
SYSTEMATIC NAME: 2-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-5-methoxy-6-oxidanyl-9-phenyl-phenalen-1-one
MOLECULAR FORMULA: C32H34O14
MOLECULAR WEIGHT: 642.60396
SMILES: COC1=C(C2=C3C(=C1)C=C(C(=O)C3=C(C=C2)C4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O
Structure:
CAS RN: 12041-97-3
CAS Name: 2,4,6,8-tetramethylhexacosanoic acid [29-[4-[[4-[[4-[[5-acetyloxy-4-[(4-hydroxy-5-methoxy-6-methyl-2-oxanyl)oxy]-3-methoxy-6-methyl-2-oxanyl]oxy]-5-hydroxy-3-methoxy-6-methyl-2-oxanyl]oxy]-3,5-dimethoxy-6-methyl-2-oxanyl]oxy]phenyl]-3-methoxy-4-methyl-9-(
OPENEYE Name: [19-[4-[4-[4-[5-acetoxy-4-(4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-3-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-5-hydroxy-3-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-3,5-dimethoxy-6-methyl-tetrahydropyran-2-yl]oxyphenyl]-1-[8-methoxy-7-methyl
IUPAC Name: [29-[4-[4-[4-[5-acetyloxy-4-(4-hydroxy-5-methoxy-6-methyloxan-2-yl)oxy-3-methoxy-6-methyloxan-2-yl]oxy-5-hydroxy-3-methoxy-6-methyloxan-2-yl]oxy-3,5-dimethoxy-6-methyloxan-2-yl]oxyphenyl]-3-methoxy-4-methyl-9-(2,4,6,8-tetramethylhexacosanoyloxy)nonacosan-
SYSTEMATIC NAME: [29-[4-[4-[4-[5-acetyloxy-3-methoxy-4-(5-methoxy-6-methyl-4-oxidanyl-oxan-2-yl)oxy-6-methyl-oxan-2-yl]oxy-3-methoxy-6-methyl-5-oxidanyl-oxan-2-yl]oxy-3,5-dimethoxy-6-methyl-oxan-2-yl]oxyphenyl]-3-methoxy-4-methyl-9-(2,4,6,8-tetramethylhexacosanoyloxy)nona
MOLECULAR FORMULA: C128H236O22
MOLECULAR WEIGHT: 2127.23024
SMILES: CCCCCCCCCCCCCCCCCCC(C)CC(C)CC(C)CC(C)C(=O)OC(CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)OC2C(C(C(C(O2)C)OC)OC3C(C(C(C(O3)C)O)OC4C(C(C(C(O4)C)OC(=O)C)OC5CC(C(C(O5)C)OC)O)OC)OC)OC)CC(CCCCC(C)C(CC)OC)OC(=O)C(C)CC(C)CC(C)CC(C)CCCCCCCCCCCCCCCCCC
Structure:
CAS RN: 10592-03-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H27ClN2O3
MOLECULAR WEIGHT: 390.90368
SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O.Cl
Structure:
CAS RN: 116286-76-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H27NO5
MOLECULAR WEIGHT: 397.46418
SMILES: CCC(=O)O[C@H]1C=C[C@H]2C3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC(=O)CC)CCN3C
Structure:
CAS RN: 10587-93-6
CAS Name: 4-[(4-amino-2,5-dichlorophenyl)methyl]-2,5-dichloroaniline
OPENEYE Name: 4-[(4-amino-2,5-dichloro-phenyl)methyl]-2,5-dichloro-aniline
IUPAC Name: 4-[(4-amino-2,5-dichlorophenyl)methyl]-2,5-dichloroaniline
SYSTEMATIC NAME: 4-[[4-azanyl-2,5-bis(chloranyl)phenyl]methyl]-2,5-bis(chloranyl)aniline
MOLECULAR FORMULA: C13H10Cl4N2
MOLECULAR WEIGHT: 336.0439
SMILES: C1=C(C(=CC(=C1Cl)N)Cl)CC2=CC(=C(C=C2Cl)N)Cl
Structure:
CAS RN: 10567-69-8
CAS Name: barium(2+) diiodate
OPENEYE Name: barium(2+) diiodate
IUPAC Name: barium(2+) diiodate
SYSTEMATIC NAME: barium(2+) diiodate
MOLECULAR FORMULA: BaI2O6
MOLECULAR WEIGHT: 487.13234
SMILES: [O-]I(=O)=O.[O-]I(=O)=O.[Ba+2]
Structure:
CAS RN: 10527-48-7
CAS Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl] [[[(2R,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate
OPENEYE Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl] hydrogen phosphate
IUPAC Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate
SYSTEMATIC NAME: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [[[(2R,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl] hydrogen phosphate
MOLECULAR FORMULA: C19H27N7O21P4
MOLECULAR WEIGHT: 813.347024
SMILES: C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)O)O)O)O
Structure:
CAS RN: 10517-44-9
CAS Name: propane-1,3-diamine dihydrochloride
OPENEYE Name: propane-1,3-diamine dihydrochloride
IUPAC Name: propane-1,3-diamine dihydrochloride
SYSTEMATIC NAME: propane-1,3-diamine dihydrochloride
MOLECULAR FORMULA: C3H12Cl2N2
MOLECULAR WEIGHT: 147.04678
SMILES: C(CN)CN.Cl.Cl
Structure:
CAS RN: 10514-62-2
CAS Name: 2-methyl-2-(2-nitrophenoxy)propanoic acid
OPENEYE Name: 2-methyl-2-(2-nitrophenoxy)propanoic acid
IUPAC Name: 2-methyl-2-(2-nitrophenoxy)propanoic acid
SYSTEMATIC NAME: 2-methyl-2-(2-nitrophenoxy)propanoic acid
MOLECULAR FORMULA: C10H11NO5
MOLECULAR WEIGHT: 225.19804
SMILES: CC(C)(C(=O)O)OC1=CC=CC=C1[N+](=O)[O-]
Structure:
CAS RN: 156497-45-9
CAS Name: 1,1-bis(2-chloroethyl)hydrazine
OPENEYE Name: 1,1-bis(2-chloroethyl)hydrazine
IUPAC Name: 1,1-bis(2-chloroethyl)hydrazine
SYSTEMATIC NAME: 1,1-bis(2-chloroethyl)diazane
MOLECULAR FORMULA: C4H10Cl2N2
MOLECULAR WEIGHT: 157.0416
SMILES: C(CCl)N(CCCl)N
Structure:
CAS RN: 10487-06-6
CAS Name: 1,1-bis(2-chloroethyl)hydrazine
OPENEYE Name: 1,1-bis(2-chloroethyl)hydrazine
IUPAC Name: 1,1-bis(2-chloroethyl)hydrazine
SYSTEMATIC NAME: 1,1-bis(2-chloroethyl)diazane
MOLECULAR FORMULA: C4H10Cl2N2
MOLECULAR WEIGHT: 157.0416
SMILES: C(CCl)N(CCCl)N
Structure:
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