CAS RN: 70882-60-9
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid 2-(4-morpholinyl)ethyl ester; oxalic acid
OPENEYE Name: 2-morpholinoethyl (E)-3-(1H-indol-3-yl)prop-2-enoate; oxalic acid
IUPAC Name: 2-morpholin-4-ylethyl (E)-3-(1H-indol-3-yl)prop-2-enoate; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; 2-morpholin-4-ylethyl (E)-3-(1H-indol-3-yl)prop-2-enoate
MOLECULAR FORMULA: C19H22N2O7
MOLECULAR WEIGHT: 390.38718
SMILES: C1COCCN1CCOC(=O)/C=C/C2=CNC3=CC=CC=C32.C(=O)(C(=O)O)O
Structure:
CAS RN: 70882-59-6
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid 2-(1-piperidinyl)ethyl ester; oxalic acid
OPENEYE Name: oxalic acid; 2-(1-piperidyl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate
IUPAC Name: oxalic acid; 2-piperidin-1-ylethyl (E)-3-(1H-indol-3-yl)prop-2-enoate
SYSTEMATIC NAME: ethanedioic acid; 2-piperidin-1-ylethyl (E)-3-(1H-indol-3-yl)prop-2-enoate
MOLECULAR FORMULA: C20H24N2O6
MOLECULAR WEIGHT: 388.41436
SMILES: C1CCN(CC1)CCOC(=O)/C=C/C2=CNC3=CC=CC=C32.C(=O)(C(=O)O)O
Structure:
CAS RN: 70882-58-5
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid 2-(dimethylamino)ethyl ester; oxalic acid
OPENEYE Name: 2-(dimethylamino)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate; oxalic acid
IUPAC Name: 2-(dimethylamino)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate; oxalic acid
SYSTEMATIC NAME: 2-(dimethylamino)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate; ethanedioic acid
MOLECULAR FORMULA: C17H20N2O6
MOLECULAR WEIGHT: 348.3505
SMILES: CN(C)CCOC(=O)/C=C/C1=CNC2=CC=CC=C21.C(=O)(C(=O)O)O
Structure:
CAS RN: 70882-57-4
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid 2-(4-methyl-4-morpholin-4-iumyl)ethyl ester iodide
OPENEYE Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
IUPAC Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
SYSTEMATIC NAME: 2-(4-methylmorpholin-4-ium-4-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
MOLECULAR FORMULA: C18H23IN2O3
MOLECULAR WEIGHT: 442.29129
SMILES: C[N+]1(CCOCC1)CCOC(=O)/C=C/C2=CNC3=CC=CC=C32.[I-]
Structure:
CAS RN: 70882-56-3
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester iodide
OPENEYE Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
SYSTEMATIC NAME: 2-(1-methylpiperidin-1-ium-1-yl)ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate iodide
MOLECULAR FORMULA: C19H25IN2O2
MOLECULAR WEIGHT: 440.31847
SMILES: C[N+]1(CCCCC1)CCOC(=O)/C=C/C2=CNC3=CC=CC=C32.[I-]
Structure:
CAS RN: 70882-54-1
CAS Name: (E)-3-(1H-indol-3-yl)-2-propenoic acid prop-2-ynyl ester
OPENEYE Name: prop-2-ynyl (E)-3-(1H-indol-3-yl)prop-2-enoate
IUPAC Name: prop-2-ynyl (E)-3-(1H-indol-3-yl)prop-2-enoate
SYSTEMATIC NAME: prop-2-ynyl (E)-3-(1H-indol-3-yl)prop-2-enoate
MOLECULAR FORMULA: C14H11NO2
MOLECULAR WEIGHT: 225.24264
SMILES: C#CCOC(=O)/C=C/C1=CNC2=CC=CC=C21
Structure:
CAS RN: 70842-93-2
CAS Name: (E)-1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-3-(3-furanyl)-2-propen-1-one
OPENEYE Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(3-furyl)prop-2-en-1-one
IUPAC Name: (E)-1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-3-(furan-3-yl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(furan-3-yl)prop-2-en-1-one
MOLECULAR FORMULA: C21H23N5O4
MOLECULAR WEIGHT: 409.43842
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)/C=C/C4=COC=C4)N)OC
Structure:
CAS RN: 70842-66-9
CAS Name: (E)-1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C23H25N5O3
MOLECULAR WEIGHT: 419.4763
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)N)OC
Structure:
CAS RN: 70591-12-7
CAS Name: (2E)-5-(4-bromophenyl)-2-[2-(4-bromophenyl)-2-oxoethylidene]-3-furanone
OPENEYE Name: (2E)-5-(4-bromophenyl)-2-[2-(4-bromophenyl)-2-oxo-ethylidene]furan-3-one
IUPAC Name: (2E)-5-(4-bromophenyl)-2-[2-(4-bromophenyl)-2-oxoethylidene]furan-3-one
SYSTEMATIC NAME: (2E)-5-(4-bromophenyl)-2-[2-(4-bromophenyl)-2-oxidanylidene-ethylidene]furan-3-one
MOLECULAR FORMULA: C18H10Br2O3
MOLECULAR WEIGHT: 434.0782
SMILES: C1=CC(=CC=C1C2=CC(=O)/C(=C\C(=O)C3=CC=C(C=C3)Br)/O2)Br
Structure:
CAS RN: 70495-57-7
CAS Name: 3-pyridinecarboxylic acid [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] ester
OPENEYE Name: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] pyridine-3-carboxylate
IUPAC Name: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] pyridine-3-carboxylate
SYSTEMATIC NAME: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] pyridine-3-carboxylate
MOLECULAR FORMULA: C51H77NO2
MOLECULAR WEIGHT: 736.16258
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)C1=CN=CC=C1)/C)/C)/C)/C)/C)/C)/C)/C)C
Structure:
CAS RN: 70495-56-6
CAS Name: acetic acid [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] ester
OPENEYE Name: [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] acetate
IUPAC Name: [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] acetate
SYSTEMATIC NAME: [(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl] ethanoate
MOLECULAR FORMULA: C57H92O2
MOLECULAR WEIGHT: 809.33918
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)C)/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)C
Structure:
CAS RN: 70495-54-4
CAS Name: 2-propenoic acid [(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] ester
OPENEYE Name: [(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] prop-2-enoate
IUPAC Name: [(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] prop-2-enoate
SYSTEMATIC NAME: [(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] prop-2-enoate
MOLECULAR FORMULA: C53H84O2
MOLECULAR WEIGHT: 753.23286
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)C=C)/C)/C)/C)/C)/C)/C)/C)/C)/C)C
Structure:
CAS RN: 70495-53-3
CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] ester
OPENEYE Name: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] 2-(4-chlorophenoxy)-2-methyl-propanoate
IUPAC Name: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] 2-(4-chlorophenoxy)-2-methylpropanoate
SYSTEMATIC NAME: [(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate
MOLECULAR FORMULA: C55H83ClO3
MOLECULAR WEIGHT: 827.69872
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)C(C)(C)OC1=CC=C(C=C1)Cl)/C)/C)/C)/C)/C)/C)/C)/C)C
Structure:
CAS RN: 70333-33-4
CAS Name: 2-hydroxy-5-[(E)-(3-oxo-2-benzofuranylidene)methyl]benzoic acid
OPENEYE Name: 2-hydroxy-5-[(E)-(3-oxobenzofuran-2-ylidene)methyl]benzoic acid
IUPAC Name: 2-hydroxy-5-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]benzoic acid
SYSTEMATIC NAME: 2-oxidanyl-5-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]benzoic acid
MOLECULAR FORMULA: C16H10O5
MOLECULAR WEIGHT: 282.2476
SMILES: C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC(=C(C=C3)O)C(=O)O)/O2
Structure:
CAS RN: 70301-68-7
CAS Name: (E)-2-butenedioic acid; 5-(3,4-dimethylphenyl)-3-(4-methyl-1-piperazinyl)-6H-pyridazino[3,4-b][1,4]benzoxazepine
OPENEYE Name: 5-(3,4-dimethylphenyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 5-(3,4-dimethylphenyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 5-(3,4-dimethylphenyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine
MOLECULAR FORMULA: C28H31N5O5
MOLECULAR WEIGHT: 517.57624
SMILES: CC1=C(C=C(C=C1)N2CC3=CC=CC=C3OC4=NN=C(C=C42)N5CCN(CC5)C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 70265-52-0
CAS Name: (E)-2-butenedioic acid; N-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]-4-phenyl-1-cyclohexanamine
OPENEYE Name: fumaric acid; N-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]-4-phenyl-cyclohexanamine
IUPAC Name: (E)-but-2-enedioic acid; N-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]-4-phenylcyclohexan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; N-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethyl]-4-phenyl-cyclohexan-1-amine
MOLECULAR FORMULA: C29H39NO8
MOLECULAR WEIGHT: 529.62186
SMILES: COC1=CC=CC=C1OCCOCCOCCNC2CCC(CC2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 70265-29-1
CAS Name: (E)-2-butenedioic acid; 1-[(5-hydroxy-1H-indol-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
OPENEYE Name: fumaric acid; 1-[(5-hydroxy-1H-indol-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
IUPAC Name: (E)-but-2-enedioic acid; 1-[(5-hydroxy-1H-indol-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[(5-oxidanyl-1H-indol-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
MOLECULAR FORMULA: C22H22N2O7
MOLECULAR WEIGHT: 426.41928
SMILES: C1CNC(C2=CC(=C(C=C21)O)O)CC3=CNC4=C3C=C(C=C4)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 70170-89-7
CAS Name: 2-[3-[(E)-(3-oxo-2-benzofuranylidene)methyl]phenoxy]acetic acid
OPENEYE Name: 2-[3-[(E)-(3-oxobenzofuran-2-ylidene)methyl]phenoxy]acetic acid
IUPAC Name: 2-[3-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[3-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C17H12O5
MOLECULAR WEIGHT: 296.27418
SMILES: C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC(=CC=C3)OCC(=O)O)/O2
Structure:
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