CAS RN: 67827-53-6
CAS Name: (E)-3-(2,4,6-trimethoxyphenyl)-2-propenoic acid ethyl ester
OPENEYE Name: ethyl (E)-3-(2,4,6-trimethoxyphenyl)prop-2-enoate
IUPAC Name: ethyl (E)-3-(2,4,6-trimethoxyphenyl)prop-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-(2,4,6-trimethoxyphenyl)prop-2-enoate
MOLECULAR FORMULA: C14H18O5
MOLECULAR WEIGHT: 266.28972
SMILES: CCOC(=O)/C=C/C1=C(C=C(C=C1OC)OC)OC
Structure:
CAS RN: 100041-05-2
CAS Name: 1-[5-(hydroxymethyl)-2-furanyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
OPENEYE Name: 1-[5-(hydroxymethyl)-2-furyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
IUPAC Name: 1-[5-(hydroxymethyl)furan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
SYSTEMATIC NAME: 1-[5-(hydroxymethyl)furan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
MOLECULAR FORMULA: C17H12N2O4
MOLECULAR WEIGHT: 308.28818
SMILES: C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC=C(O4)CO)C(=O)O
Structure:
CAS RN: 13022-19-0
CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-8-quinolinecarboxylic acid
OPENEYE Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]quinoline-8-carboxylic acid
IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-8-carboxylic acid
SYSTEMATIC NAME: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-8-carboxylic acid
MOLECULAR FORMULA: C16H10N2O5
MOLECULAR WEIGHT: 310.261
SMILES: C1=CC2=C(C(=C1)C(=O)O)N=C(C=C2)/C=C/C3=CC=C(O3)[N+](=O)[O-]
Structure:
CAS RN: 147933-55-9
CAS Name: (Z)-9-octadecenoic acid hexadecyl ester
OPENEYE Name: hexadecyl (Z)-octadec-9-enoate
IUPAC Name: hexadecyl (Z)-octadec-9-enoate
SYSTEMATIC NAME: hexadecyl (Z)-octadec-9-enoate
MOLECULAR FORMULA: C34H66O2
MOLECULAR WEIGHT: 506.88664
SMILES: CCCCCCCCCCCCCCCCOC(=O)CCCCCCC/C=C\CCCCCCCC
Structure:
CAS RN: 22393-86-8
CAS Name: (Z)-9-octadecenoic acid hexadecyl ester
OPENEYE Name: hexadecyl (Z)-octadec-9-enoate
IUPAC Name: hexadecyl (Z)-octadec-9-enoate
SYSTEMATIC NAME: hexadecyl (Z)-octadec-9-enoate
MOLECULAR FORMULA: C34H66O2
MOLECULAR WEIGHT: 506.88664
SMILES: CCCCCCCCCCCCCCCCOC(=O)CCCCCCC/C=C\CCCCCCCC
Structure:
CAS RN: 798-64-1
CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinolinecarboxamide
OPENEYE Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]quinoline-4-carboxamide
IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide
SYSTEMATIC NAME: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide
MOLECULAR FORMULA: C16H11N3O4
MOLECULAR WEIGHT: 309.27624
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)N
Structure:
CAS RN: 21994-54-7
CAS Name: (Z)-3-[4-(dimethylamino)phenyl]-2-(4-methylphenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-[4-(dimethylamino)phenyl]-2-(p-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-3-[4-(dimethylamino)phenyl]-2-(4-methylphenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[4-(dimethylamino)phenyl]-2-(4-methylphenyl)prop-2-enenitrile
MOLECULAR FORMULA: C18H18N2
MOLECULAR WEIGHT: 262.34892
SMILES: CC1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)N(C)C)/C#N
Structure:
CAS RN: 28081-12-1
CAS Name: (E)-3-(4-chlorophenyl)-1-(4-fluorophenyl)-2-propen-1-one
OPENEYE Name: (E)-3-(4-chlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one
IUPAC Name: (E)-3-(4-chlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-chlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one
MOLECULAR FORMULA: C15H10ClFO
MOLECULAR WEIGHT: 260.690703
SMILES: C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)F)Cl
Structure:
CAS RN: 1732-37-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H22O11
MOLECULAR WEIGHT: 546.47838
SMILES: CC1=CC(=C2C3=C1C(=O)C4C(C3(COC2=O)C5C4(C6=C7C(=COC(=O)C7=C(C=C6C)O)C5=O)OC)OC(=O)C)O
Structure:
CAS RN: 6028-92-8
CAS Name: (E)-1-(4-nitrophenyl)-3-thiophen-2-yl-2-propen-1-one
OPENEYE Name: (E)-1-(4-nitrophenyl)-3-(2-thienyl)prop-2-en-1-one
IUPAC Name: (E)-1-(4-nitrophenyl)-3-thiophen-2-ylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-nitrophenyl)-3-thiophen-2-yl-prop-2-en-1-one
MOLECULAR FORMULA: C13H9NO3S
MOLECULAR WEIGHT: 259.28046
SMILES: C1=CSC(=C1)/C=C/C(=O)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 60725-93-1
CAS Name: (E)-1-(4-nitrophenyl)-3-thiophen-2-yl-2-propen-1-one
OPENEYE Name: (E)-1-(4-nitrophenyl)-3-(2-thienyl)prop-2-en-1-one
IUPAC Name: (E)-1-(4-nitrophenyl)-3-thiophen-2-ylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-nitrophenyl)-3-thiophen-2-yl-prop-2-en-1-one
MOLECULAR FORMULA: C13H9NO3S
MOLECULAR WEIGHT: 259.28046
SMILES: C1=CSC(=C1)/C=C/C(=O)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 17270-12-1
CAS Name: 7-chloro-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one
OPENEYE Name: 7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one
IUPAC Name: 7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C15H11ClN2O2
MOLECULAR WEIGHT: 286.71304
SMILES: C1C(=O)NC2=C(C=C(C=C2)Cl)C(=C3C=CC(=O)C=C3)N1
Structure:
CAS RN: 1218-24-2
CAS Name: (E)-1-(5-chloro-2-hydroxyphenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(5-chloro-2-hydroxy-phenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(5-chloro-2-hydroxyphenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(5-chloranyl-2-oxidanyl-phenyl)-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11ClO2
MOLECULAR WEIGHT: 258.69964
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=C(C=CC(=C2)Cl)O
Structure:
CAS RN: 31368-51-1
CAS Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
OPENEYE Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
IUPAC Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
SYSTEMATIC NAME: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
MOLECULAR FORMULA: C20H18
MOLECULAR WEIGHT: 258.35692
SMILES: C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 3029-40-1
CAS Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
OPENEYE Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
IUPAC Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
SYSTEMATIC NAME: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
MOLECULAR FORMULA: C20H18
MOLECULAR WEIGHT: 258.35692
SMILES: C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 22828-29-1
CAS Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
OPENEYE Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
IUPAC Name: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
SYSTEMATIC NAME: [(1E,3E,5E,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
MOLECULAR FORMULA: C20H18
MOLECULAR WEIGHT: 258.35692
SMILES: C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 525-15-5
CAS Name: 1-[(2-methylphenyl)methyl]-9H-pyrido[3,4-b]indole
OPENEYE Name: 1-(o-tolylmethyl)-9H-pyrido[3,4-b]indole
IUPAC Name: 1-[(2-methylphenyl)methyl]-9H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 1-[(2-methylphenyl)methyl]-9H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C19H16N2
MOLECULAR WEIGHT: 272.34374
SMILES: CC1=CC=CC=C1CC2=NC=CC3=C2NC4=CC=CC=C34
Structure:
CAS RN: 90481-46-2
CAS Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methoxy-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methoxy-cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methoxycyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methoxy-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H11NO2S
MOLECULAR WEIGHT: 257.30764
SMILES: COC1=CC(=O)/C(=C\2/NC3=CC=CC=C3S2)/C=C1
Structure:
CAS RN: 3155-24-6
CAS Name: (6E)-6-[[(4-nitrophenyl)hydrazo]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[[2-(4-nitrophenyl)hydrazino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[[2-(4-nitrophenyl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[[2-(4-nitrophenyl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C13H11N3O3
MOLECULAR WEIGHT: 257.24474
SMILES: C1=C/C(=C\NNC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)C=C1
Structure:
CAS RN: 29862-10-0
CAS Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)-2-propen-1-one
OPENEYE Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
IUPAC Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
MOLECULAR FORMULA: C16H13FO2
MOLECULAR WEIGHT: 256.271623
SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)F
Structure:
CAS RN: 2965-64-2
CAS Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)-2-propen-1-one
OPENEYE Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
IUPAC Name: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
MOLECULAR FORMULA: C16H13FO2
MOLECULAR WEIGHT: 256.271623
SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)F
Structure:
CAS RN: 5803-51-0
CAS Name: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
OPENEYE Name: 4-[(E)-2-(2,5-dimethoxyphenyl)vinyl]aniline
IUPAC Name: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
SYSTEMATIC NAME: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
MOLECULAR FORMULA: C16H17NO2
MOLECULAR WEIGHT: 255.31168
SMILES: COC1=CC(=C(C=C1)OC)/C=C/C2=CC=C(C=C2)N
Structure:
CAS RN: 23435-31-6
CAS Name: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
OPENEYE Name: 4-[(E)-2-(2,5-dimethoxyphenyl)vinyl]aniline
IUPAC Name: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
SYSTEMATIC NAME: 4-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]aniline
MOLECULAR FORMULA: C16H17NO2
MOLECULAR WEIGHT: 255.31168
SMILES: COC1=CC(=C(C=C1)OC)/C=C/C2=CC=C(C=C2)N
Structure:
CAS RN: 1222-98-6
CAS Name: (E)-3-(4-nitrophenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(4-nitrophenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(4-nitrophenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-nitrophenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11NO3
MOLECULAR WEIGHT: 253.25274
SMILES: C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 2960-55-6
CAS Name: (E)-3-(4-nitrophenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(4-nitrophenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(4-nitrophenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-nitrophenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11NO3
MOLECULAR WEIGHT: 253.25274
SMILES: C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
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