CAS RN: 7253-86-3
CAS Name: 3-[8,13-dicyano-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid methyl ester
OPENEYE Name: methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxo-propyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
IUPAC Name: methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
SYSTEMATIC NAME: methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxidanylidene-propyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
MOLECULAR FORMULA: C34H32N6O4
MOLECULAR WEIGHT: 588.65568
SMILES: CC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C#N)C)C#N
Structure:
CAS RN: 6317-41-5
CAS Name: 2-amino-3-oxohexanedioic acid dimethyl ester
OPENEYE Name: dimethyl 2-amino-3-oxo-hexanedioate
IUPAC Name: dimethyl 2-amino-3-oxohexanedioate
SYSTEMATIC NAME: dimethyl 2-azanyl-3-oxidanylidene-hexanedioate
MOLECULAR FORMULA: C8H13NO5
MOLECULAR WEIGHT: 203.19252
SMILES: COC(=O)CCC(=O)C(C(=O)OC)N
Structure:
CAS RN: 6953-74-8
CAS Name: 2-(1H-benzimidazol-2-ylmethyl)-1-nitroguanidine
OPENEYE Name: 2-(1H-benzimidazol-2-ylmethyl)-1-nitro-guanidine
IUPAC Name: 2-(1H-benzimidazol-2-ylmethyl)-1-nitroguanidine
SYSTEMATIC NAME: 2-(1H-benzimidazol-2-ylmethyl)-1-nitro-guanidine
MOLECULAR FORMULA: C9H10N6O2
MOLECULAR WEIGHT: 234.2147
SMILES: C1=CC=C2C(=C1)NC(=N2)CN=C(N)N[N+](=O)[O-]
Structure:
CAS RN: 6336-19-2
CAS Name: 2-[2-(methylthio)ethyl]-1-nitroguanidine
OPENEYE Name: 2-(2-methylsulfanylethyl)-1-nitro-guanidine
IUPAC Name: 2-(2-methylsulfanylethyl)-1-nitroguanidine
SYSTEMATIC NAME: 2-(2-methylsulfanylethyl)-1-nitro-guanidine
MOLECULAR FORMULA: C4H10N4O2S
MOLECULAR WEIGHT: 178.2128
SMILES: CSCCN=C(N)N[N+](=O)[O-]
Structure:
CAS RN: 93783-21-2
CAS Name: 2-(3-ethyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; sulfuric acid ethyl ester
OPENEYE Name: 2-(3-ethyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; ethyl hydrogen sulfate
IUPAC Name: 2-(3-ethyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; ethyl hydrogen sulfate
SYSTEMATIC NAME: 2-(3-ethyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; ethyl hydrogen sulfate
MOLECULAR FORMULA: C26H55N2O5S+
MOLECULAR WEIGHT: 507.7903
SMILES: CCCCCCCCCCCCCCCCCC1=[N+](CCN1CC)CCO.CCOS(=O)(=O)O
Structure:
CAS RN: 6336-60-3
CAS Name: 2-[ethyl-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl]amino]ethanol
OPENEYE Name: 2-[ethyl-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl]amino]ethanol
IUPAC Name: 2-[ethyl-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl]amino]ethanol
SYSTEMATIC NAME: 2-[ethyl-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl]amino]ethanol
MOLECULAR FORMULA: C13H25NO5
MOLECULAR WEIGHT: 275.3413
SMILES: CCN(CCO)CC1C2C(C(O1)OC)OC(O2)(C)C
Structure:
CAS RN: 960-77-0
CAS Name: N,N-dimethyl-3-(2-methyl-7-nitro-1-benzimidazolyl)-1-propanamine
OPENEYE Name: N,N-dimethyl-3-(2-methyl-7-nitro-benzimidazol-1-yl)propan-1-amine
IUPAC Name: N,N-dimethyl-3-(2-methyl-7-nitrobenzimidazol-1-yl)propan-1-amine
SYSTEMATIC NAME: N,N-dimethyl-3-(2-methyl-7-nitro-benzimidazol-1-yl)propan-1-amine
MOLECULAR FORMULA: C13H18N4O2
MOLECULAR WEIGHT: 262.30762
SMILES: CC1=NC2=C(N1CCCN(C)C)C(=CC=C2)[N+](=O)[O-]
Structure:
CAS RN: 51030-24-1
CAS Name: 1,2,8-trihydroxyanthracene-9,10-dione
OPENEYE Name: 1,2,8-trihydroxyanthracene-9,10-dione
IUPAC Name: 1,2,8-trihydroxyanthracene-9,10-dione
SYSTEMATIC NAME: 1,2,8-tris(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C14H8O5
MOLECULAR WEIGHT: 256.21032
SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC(=C3O)O
Structure:
CAS RN: 6333-13-7
CAS Name: carbamimidic acid (4-chlorophenyl) ester
OPENEYE Name: 2-(4-chlorophenyl)isourea
IUPAC Name: (4-chlorophenyl) carbamimidate
SYSTEMATIC NAME: (4-chlorophenyl) carbamimidate
MOLECULAR FORMULA: C7H7ClN2O
MOLECULAR WEIGHT: 170.59628
SMILES: C1=CC(=CC=C1OC(=N)N)Cl
Structure:
CAS RN: 69796-48-1
CAS Name: 1,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dione
OPENEYE Name: 1,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-tetrahydrofuran]-2',5'-dione
IUPAC Name: 1,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dione
SYSTEMATIC NAME: 1,2,3,4,7,7-hexakis(chloranyl)spiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dione
MOLECULAR FORMULA: C10H4Cl6O3
MOLECULAR WEIGHT: 384.85496
SMILES: C1C(=O)OC(=O)C12CC3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl
Structure:
CAS RN: 102647-16-5
CAS Name: 2-methylpropanoic acid [6-[[6-[[6-[[6-[[4-acetyloxy-5-[(4-hydroxy-5-methoxy-6-methyl-2-oxanyl)oxy]-6-methyl-2-oxanyl]oxy]-3-(3,4-dihydroxy-1-methoxy-2-oxopentyl)-8,9-dihydroxy-1-oxo-3,4-dihydro-2H-anthracen-2-yl]oxy]-3-hydroxy-2-methyl-4-oxanyl]oxy]-3-hyd
OPENEYE Name: [6-[6-[6-[[6-[4-acetoxy-5-(4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-6-methyl-tetrahydropyran-2-yl]oxy-3-(3,4-dihydroxy-1-methoxy-2-oxo-pentyl)-8,9-dihydroxy-1-oxo-3,4-dihydro-2H-anthracen-2-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]oxy-
IUPAC Name: [6-[6-[6-[[6-[4-acetyloxy-5-(4-hydroxy-5-methoxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-3-(3,4-dihydroxy-1-methoxy-2-oxopentyl)-8,9-dihydroxy-1-oxo-3,4-dihydro-2H-anthracen-2-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]oxy-3-hydroxy-2-methyloxan-4-yl]oxy-4-h
SYSTEMATIC NAME: [6-[6-[6-[[6-[4-acetyloxy-5-(5-methoxy-6-methyl-4-oxidanyl-oxan-2-yl)oxy-6-methyl-oxan-2-yl]oxy-3-[1-methoxy-3,4-bis(oxidanyl)-2-oxidanylidene-pentyl]-8,9-bis(oxidanyl)-1-oxidanylidene-3,4-dihydro-2H-anthracen-2-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]oxy-2
MOLECULAR FORMULA: C58H84O26
MOLECULAR WEIGHT: 1197.27196
SMILES: CC1C(C(CC(O1)OC2C(CC3=C(C2=O)C(=C4C(=C3)C=C(C=C4O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC)O)OC(=O)C)O)C(C(=O)C(C(C)O)O)OC)OC7CC(C(C(O7)C)O)OC8CC(C(C(O8)C)OC(=O)C(C)C)(C)O)O
Structure:
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