CAS RN: 72943-36-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C50H64N4O13
MOLECULAR WEIGHT: 929.06216
SMILES: CC1/C=C/C=C(/C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C\NN5CCN(CC5)CC6=CC(=CC=C6)OC)C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C
Structure:
CAS RN: 4463-44-9
CAS Name: 4-[(E)-[4-(ethylamino)-3-methylphenyl]-(4-ethylimino-3-methyl-1-cyclohexa-2,5-dienylidene)methyl]-6-hydroxybenzene-1,3-disulfonic acid; sodium
OPENEYE Name: 4-[(E)-[4-(ethylamino)-3-methyl-phenyl]-(4-ethylimino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]-6-hydroxy-benzene-1,3-disulfonic acid; sodium
IUPAC Name: 4-[(E)-[4-(ethylamino)-3-methylphenyl]-(4-ethylimino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]-6-hydroxybenzene-1,3-disulfonic acid; sodium
SYSTEMATIC NAME: 4-[(E)-[4-(ethylamino)-3-methyl-phenyl]-(4-ethylimino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]-6-oxidanyl-benzene-1,3-disulfonic acid; sodium
MOLECULAR FORMULA: C25H28N2NaO7S2
MOLECULAR WEIGHT: 555.61879
SMILES: CCNC1=C(C=C(C=C1)/C(=C\2/C=CC(=NCC)C(=C2)C)/C3=CC(=C(C=C3S(=O)(=O)O)S(=O)(=O)O)O)C.[Na]
Structure:
CAS RN: 3999-42-6
CAS Name: (2,6-dimethyl-2H-pyridin-1-yl)boron
OPENEYE Name: (2,6-dimethyl-2H-pyridin-1-yl)boron
IUPAC Name: (2,6-dimethyl-2H-pyridin-1-yl)boron
SYSTEMATIC NAME: (2,6-dimethyl-2H-pyridin-1-yl)boron
MOLECULAR FORMULA: C7H10BN
MOLECULAR WEIGHT: 118.972
SMILES: [B]N1C(C=CC=C1C)C
Structure:
CAS RN: 15718-51-1
CAS Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-2-pyrimidinone; sodium
OPENEYE Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; sodium
IUPAC Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; sodium
SYSTEMATIC NAME: 4-azanyl-1-[6-(hydroxymethyl)-2-oxidanyl-2-oxidanylidene-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; sodium
MOLECULAR FORMULA: C9H12N3NaO7P
MOLECULAR WEIGHT: 328.171011
SMILES: C1=CN(C(=O)N=C1N)C2C3C(C(O2)CO)OP(=O)(O3)O.[Na]
Structure:
CAS RN: 50962-07-7
CAS Name: 2-(hexadecylamino)ethanol hydrochloride
OPENEYE Name: 2-(hexadecylamino)ethanol hydrochloride
IUPAC Name: 2-(hexadecylamino)ethanol hydrochloride
SYSTEMATIC NAME: 2-(hexadecylamino)ethanol hydrochloride
MOLECULAR FORMULA: C18H40ClNO
MOLECULAR WEIGHT: 321.9693
SMILES: CCCCCCCCCCCCCCCCNCCO.Cl
Structure:
CAS RN: 66996-55-2
CAS Name: N-[[1-[(2S,4S)-4-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethylidene]amino]-3,4-dichlorobenzamide hydrochloride
OPENEYE Name: N-[[1-[(2S,4S)-4-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxy-ethylidene]amino]-3,4-dichloro-benzamide hydrochloride
IUPAC Name: N-[[1-[(2S,4S)-4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethylidene]amino]-3,4-dichlorobenzamide hydrochloride
SYSTEMATIC NAME: N-[[1-[(2S,4S)-4-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-7-methoxy-2,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-3,4-dihydro-1H-tetracen-2-yl]-2-oxidanyl-ethylidene]amino]-3,4-bis(chloranyl)benzamide hydrochloride
MOLECULAR FORMULA: C34H34Cl3N3O11
MOLECULAR WEIGHT: 767.00626
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=NNC(=O)C6=CC(=C(C=C6)Cl)Cl)CO)O)N)O.Cl
Structure:
CAS RN: 58199-97-6
CAS Name: (2S,4S)-4-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid methyl ester hydrochloride
OPENEYE Name: methyl (2S,4S)-4-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylate hydrochloride
IUPAC Name: methyl (2S,4S)-4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylate hydrochloride
SYSTEMATIC NAME: methyl (2S,4S)-4-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-7-methoxy-2,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-3,4-dihydro-1H-tetracene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C27H30ClNO11
MOLECULAR WEIGHT: 579.9802
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)OC)O)N)O.Cl
Structure:
CAS RN: 42776-00-1
CAS Name: 1-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl]-3-pyridin-1-iumcarboxamide chloride
OPENEYE Name: 1-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl]pyridin-1-ium-3-carboxamide chloride
IUPAC Name: 1-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridin-1-ium-3-carboxamide chloride
SYSTEMATIC NAME: 1-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]pyridin-1-ium-3-carboxamide chloride
MOLECULAR FORMULA: C15H17ClN6O3
MOLECULAR WEIGHT: 364.78688
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[N+]3=CC=CC(=C3)C(=O)N.[Cl-]
Structure:
CAS RN: 66996-51-8
CAS Name: N-[1-[(2S,4S)-4-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethylideneamino]-4-phenylbenzamide hydrochloride
OPENEYE Name: N-[1-[(2S,4S)-4-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethylideneamino]-4-phenyl-benzamide hydrochloride
IUPAC Name: N-[1-[(2S,4S)-4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethylideneamino]-4-phenylbenzamide hydrochloride
SYSTEMATIC NAME: N-[1-[(2S,4S)-4-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-7-methoxy-2,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-3,4-dihydro-1H-tetracen-2-yl]ethylideneamino]-4-phenyl-benzamide hydrochloride
MOLECULAR FORMULA: C40H40ClN3O10
MOLECULAR WEIGHT: 758.2127
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=NNC(=O)C6=CC=C(C=C6)C7=CC=CC=C7)C)O)N)O.Cl
Structure:
CAS RN: 64659-74-1
CAS Name: dichloropalladium; dicyclohexylphosphine
OPENEYE Name: dichloropalladium; dicyclohexylphosphane
IUPAC Name: dichloropalladium; dicyclohexylphosphane
SYSTEMATIC NAME: bis(chloranyl)palladium; dicyclohexylphosphane
MOLECULAR FORMULA: C24H46Cl2P2Pd
MOLECULAR WEIGHT: 573.895562
SMILES: C1CCC(CC1)PC2CCCCC2.C1CCC(CC1)PC2CCCCC2.Cl[Pd]Cl
Structure:
CAS RN: 61593-73-5
CAS Name: (2-azanidylcyclohexyl)azanide; 2-hydroxypropanedioic acid; platinum(2+)
OPENEYE Name: (2-azanidylcyclohexyl)azanide; 2-hydroxypropanedioic acid; platinum(2+)
IUPAC Name: (2-azanidylcyclohexyl)azanide; 2-hydroxypropanedioic acid; platinum(2+)
SYSTEMATIC NAME: (2-azanidylcyclohexyl)azanide; 2-oxidanylpropanedioic acid; platinum(2+)
MOLECULAR FORMULA: C9H16N2O5Pt
MOLECULAR WEIGHT: 427.31174
SMILES: C1CCC(C(C1)[NH-])[NH-].C(C(=O)O)(C(=O)O)O.[Pt+2]
Structure:
CAS RN: 58199-96-5
CAS Name: (2S,4S)-4-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid hydrochloride
OPENEYE Name: (2S,4S)-4-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid hydrochloride
IUPAC Name: (2S,4S)-4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: (2S,4S)-4-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-7-methoxy-2,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-3,4-dihydro-1H-tetracene-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C26H28ClNO11
MOLECULAR WEIGHT: 565.95362
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)O)O)N)O.Cl
Structure:
CAS RN: 71039-59-3
CAS Name: 3-aminopropanoic acid [(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl] ester hydrochloride
OPENEYE Name: [(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl] 3-aminopropanoate hydrochloride
IUPAC Name: [(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl] 3-aminopropanoate hydrochloride
SYSTEMATIC NAME: [(1S,3S)-3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl] 3-azanylpropanoate hydrochloride
MOLECULAR FORMULA: C24H24ClNO9
MOLECULAR WEIGHT: 505.90166
SMILES: CC(=O)[C@]1(C[C@@H](C2=C(C3=C(C(=C2C1)O)C(=O)C4=C(C3=O)C(=CC=C4)OC)O)OC(=O)CCN)O.Cl
Structure:
CAS RN: 57963-33-4
CAS Name: 2-[[4-[(2,4-diamino-6-pteridinyl)methylamino]phenyl]sulfonylamino]pentanedioic acid; magnesium
OPENEYE Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]sulfonylamino]pentanedioic acid; magnesium
IUPAC Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]sulfonylamino]pentanedioic acid; magnesium
SYSTEMATIC NAME: 2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]phenyl]sulfonylamino]pentanedioic acid; magnesium
MOLECULAR FORMULA: C18H20MgN8O6S
MOLECULAR WEIGHT: 500.7714
SMILES: C1=CC(=CC=C1NCC2=CN=C3C(=N2)C(=NC(=N3)N)N)S(=O)(=O)NC(CCC(=O)O)C(=O)O.[Mg]
Structure:
CAS RN: 34966-09-1
CAS Name: 1-ethyl-4-(1-piperidinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 1-ethyl-4-(1-piperidyl)pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride
IUPAC Name: ethyl 1-ethyl-4-piperidin-1-ylpyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl 1-ethyl-4-piperidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride
MOLECULAR FORMULA: C16H23ClN4O2
MOLECULAR WEIGHT: 338.83242
SMILES: CCN1C2=NC=C(C(=C2C=N1)N3CCCCC3)C(=O)OCC.Cl
Structure:
CAS RN: 58297-07-7
CAS Name: [4-[(dimethylhydrazinylidene)methyl]phenyl]-trimethylammonium iodide
OPENEYE Name: [4-[(dimethylhydrazono)methyl]phenyl]-trimethyl-ammonium iodide
IUPAC Name: [4-[(dimethylhydrazinylidene)methyl]phenyl]-trimethylazanium iodide
SYSTEMATIC NAME: [4-[(dimethylhydrazinylidene)methyl]phenyl]-trimethyl-azanium iodide
MOLECULAR FORMULA: C12H20IN3
MOLECULAR WEIGHT: 333.21177
SMILES: CN(C)N=CC1=CC=C(C=C1)[N+](C)(C)C.[I-]
Structure:
CAS RN: 64894-81-1
CAS Name: 4-(9-acridinylamino)benzoic acid; sodium
OPENEYE Name: 4-(acridin-9-ylamino)benzoic acid; sodium
IUPAC Name: 4-(acridin-9-ylamino)benzoic acid; sodium
SYSTEMATIC NAME: 4-(acridin-9-ylamino)benzoic acid; sodium
MOLECULAR FORMULA: C20H14N2NaO2
MOLECULAR WEIGHT: 337.32713
SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)C(=O)O.[Na]
Structure:
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