CAS RN: 7497-92-9
CAS Name: 3-(4-methylphenoxy)propanoic acid methyl ester
OPENEYE Name: methyl 3-(4-methylphenoxy)propanoate
IUPAC Name: methyl 3-(4-methylphenoxy)propanoate
SYSTEMATIC NAME: methyl 3-(4-methylphenoxy)propanoate
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC1=CC=C(C=C1)OCCC(=O)OC
Structure:
CAS RN: 7497-91-8
CAS Name: 3-(2-methylphenoxy)propanoic acid methyl ester
OPENEYE Name: methyl 3-(2-methylphenoxy)propanoate
IUPAC Name: methyl 3-(2-methylphenoxy)propanoate
SYSTEMATIC NAME: methyl 3-(2-methylphenoxy)propanoate
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC1=CC=CC=C1OCCC(=O)OC
Structure:
CAS RN: 2585-25-3
CAS Name: N-(2-methylpropyl)-4-nitrobenzamide
OPENEYE Name: N-isobutyl-4-nitro-benzamide
IUPAC Name: N-(2-methylpropyl)-4-nitrobenzamide
SYSTEMATIC NAME: N-(2-methylpropyl)-4-nitro-benzamide
MOLECULAR FORMULA: C11H14N2O3
MOLECULAR WEIGHT: 222.24046
SMILES: CC(C)CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:
CAS RN: 51207-98-8
CAS Name: N-butyl-4-nitrobenzamide
OPENEYE Name: N-butyl-4-nitro-benzamide
IUPAC Name: N-butyl-4-nitrobenzamide
SYSTEMATIC NAME: N-butyl-4-nitro-benzamide
MOLECULAR FORMULA: C11H14N2O3
MOLECULAR WEIGHT: 222.24046
SMILES: CCCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:
CAS RN: 7497-90-7
CAS Name: 2-acetyloxy-2-methylpropanoic acid (1-methoxy-1-oxopropan-2-yl) ester
OPENEYE Name: (2-methoxy-1-methyl-2-oxo-ethyl) 2-acetoxy-2-methyl-propanoate
IUPAC Name: (1-methoxy-1-oxopropan-2-yl) 2-acetyloxy-2-methylpropanoate
SYSTEMATIC NAME: (1-methoxy-1-oxidanylidene-propan-2-yl) 2-acetyloxy-2-methyl-propanoate
MOLECULAR FORMULA: C10H16O6
MOLECULAR WEIGHT: 232.23044
SMILES: CC(C(=O)OC)OC(=O)C(C)(C)OC(=O)C
Structure:
CAS RN: 7497-89-4
CAS Name: 3-phenoxypropanoic acid methyl ester
OPENEYE Name: methyl 3-phenoxypropanoate
IUPAC Name: methyl 3-phenoxypropanoate
SYSTEMATIC NAME: methyl 3-phenoxypropanoate
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: COC(=O)CCOC1=CC=CC=C1
Structure:
CAS RN: 38681-76-4
CAS Name: 4-nitro-N-propan-2-ylbenzamide
OPENEYE Name: N-isopropyl-4-nitro-benzamide
IUPAC Name: 4-nitro-N-propan-2-ylbenzamide
SYSTEMATIC NAME: 4-nitro-N-propan-2-yl-benzamide
MOLECULAR FORMULA: C10H12N2O3
MOLECULAR WEIGHT: 208.21388
SMILES: CC(C)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:
CAS RN: 50445-50-6
CAS Name: N-ethyl-4-nitrobenzamide
OPENEYE Name: N-ethyl-4-nitro-benzamide
IUPAC Name: N-ethyl-4-nitrobenzamide
SYSTEMATIC NAME: N-ethyl-4-nitro-benzamide
MOLECULAR FORMULA: C9H10N2O3
MOLECULAR WEIGHT: 194.1873
SMILES: CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:
CAS RN: 7497-87-2
CAS Name: 1-bromo-4-(3-bromopropoxy)benzene
OPENEYE Name: 1-bromo-4-(3-bromopropoxy)benzene
IUPAC Name: 1-bromo-4-(3-bromopropoxy)benzene
SYSTEMATIC NAME: 1-bromanyl-4-(3-bromanylpropoxy)benzene
MOLECULAR FORMULA: C9H10Br2O
MOLECULAR WEIGHT: 293.9831
SMILES: C1=CC(=CC=C1OCCCBr)Br
Structure:
CAS RN: 85263-00-9
CAS Name: acetic acid (3,4-dichlorophenyl)methyl ester
OPENEYE Name: (3,4-dichlorophenyl)methyl acetate
IUPAC Name: (3,4-dichlorophenyl)methyl acetate
SYSTEMATIC NAME: (3,4-dichlorophenyl)methyl ethanoate
MOLECULAR FORMULA: C9H8Cl2O2
MOLECULAR WEIGHT: 219.06462
SMILES: CC(=O)OCC1=CC(=C(C=C1)Cl)Cl
Structure:
CAS RN: 2585-23-1
CAS Name: N-methyl-4-nitrobenzamide
OPENEYE Name: N-methyl-4-nitro-benzamide
IUPAC Name: N-methyl-4-nitrobenzamide
SYSTEMATIC NAME: N-methyl-4-nitro-benzamide
MOLECULAR FORMULA: C8H8N2O3
MOLECULAR WEIGHT: 180.16072
SMILES: CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Structure:
CAS RN: 2037-15-2
CAS Name: 2-hydroxypropanoic acid (1-methoxy-1-oxopropan-2-yl) ester
OPENEYE Name: (2-methoxy-1-methyl-2-oxo-ethyl) 2-hydroxypropanoate
IUPAC Name: (1-methoxy-1-oxopropan-2-yl) 2-hydroxypropanoate
SYSTEMATIC NAME: (1-methoxy-1-oxidanylidene-propan-2-yl) 2-oxidanylpropanoate
MOLECULAR FORMULA: C7H12O5
MOLECULAR WEIGHT: 176.16718
SMILES: CC(C(=O)OC(C)C(=O)OC)O
Structure:
CAS RN: 15805-98-8
CAS Name: 2-acetyloxy-2-methylpropanoic acid
OPENEYE Name: 2-acetoxy-2-methyl-propanoic acid
IUPAC Name: 2-acetyloxy-2-methylpropanoic acid
SYSTEMATIC NAME: 2-acetyloxy-2-methyl-propanoic acid
MOLECULAR FORMULA: C6H10O4
MOLECULAR WEIGHT: 146.1412
SMILES: CC(=O)OC(C)(C)C(=O)O
Structure:
CAS RN: 5166-56-3
CAS Name: hexanedioic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] hexanedioate
IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] hexanedioate
SYSTEMATIC NAME: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] hexanedioate
MOLECULAR FORMULA: C34H30O6
MOLECULAR WEIGHT: 534.5984
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)CCCCC(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
Structure:
CAS RN: 5166-50-7
CAS Name: pentanedioic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] pentanedioate
IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] pentanedioate
SYSTEMATIC NAME: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] pentanedioate
MOLECULAR FORMULA: C33H28O6
MOLECULAR WEIGHT: 520.57182
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)CCCC(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
Structure:
CAS RN: 7497-84-9
CAS Name: 2,3-dihydroxybutanedioic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] 2,3-dihydroxybutanedioate
IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] 2,3-dihydroxybutanedioate
SYSTEMATIC NAME: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2,3-bis(oxidanyl)butanedioate
MOLECULAR FORMULA: C32H26O8
MOLECULAR WEIGHT: 538.54404
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C(C(C(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)O)O
Structure:
CAS RN: 7497-83-8
CAS Name: propanedioic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] propanedioate
IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] propanedioate
SYSTEMATIC NAME: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] propanedioate
MOLECULAR FORMULA: C31H24O6
MOLECULAR WEIGHT: 492.51866
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)CC(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
Structure:
CAS RN: 7497-82-7
CAS Name: oxalic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] oxalate
IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] oxalate
SYSTEMATIC NAME: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] ethanedioate
MOLECULAR FORMULA: C30H22O6
MOLECULAR WEIGHT: 478.49208
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C(=O)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
Structure:
CAS RN: 4376-36-7
CAS Name: nonanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] nonanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] nonanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] nonanoate
MOLECULAR FORMULA: C23H28O3
MOLECULAR WEIGHT: 352.46662
SMILES: CCCCCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 7497-81-6
CAS Name: 2-benzamidoacetic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-benzamidoacetate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-benzamidoacetate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-benzamidoethanoate
MOLECULAR FORMULA: C23H19NO4
MOLECULAR WEIGHT: 373.40126
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)CNC(=O)C3=CC=CC=C3
Structure:
CAS RN: 7497-80-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H18O3
MOLECULAR WEIGHT: 330.37652
SMILES: CC1=CC=C(C=C1)C23CC(C=C2)(C4C3C(=O)OC4=O)C5=CC=CC=C5
Structure:
CAS RN: 7598-47-2
CAS Name: 5-methylhexanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
MOLECULAR FORMULA: C21H24O3
MOLECULAR WEIGHT: 324.41346
SMILES: CC(C)CCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 4376-35-6
CAS Name: heptanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] heptanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] heptanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] heptanoate
MOLECULAR FORMULA: C21H24O3
MOLECULAR WEIGHT: 324.41346
SMILES: CCCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 7497-78-1
CAS Name: 4-methylhexanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-methylhexanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-methylhexanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 4-methylhexanoate
MOLECULAR FORMULA: C21H24O3
MOLECULAR WEIGHT: 324.41346
SMILES: CCC(C)CCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 7497-77-0
CAS Name: 3,4,5-trihydroxybenzoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 3,4,5-trihydroxybenzoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 3,4,5-trihydroxybenzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 3,4,5-tris(oxidanyl)benzoate
MOLECULAR FORMULA: C21H16O6
MOLECULAR WEIGHT: 364.34814
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=C(C(=C3)O)O)O
Structure:
CAS RN: 4347-81-3
CAS Name: 4-hydroxybenzoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-hydroxybenzoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-hydroxybenzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 4-oxidanylbenzoate
MOLECULAR FORMULA: C21H16O4
MOLECULAR WEIGHT: 332.34934
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)O
Structure:
CAS RN: 7598-46-1
CAS Name: 2,2-dimethylbutanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2,2-dimethylbutanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2,2-dimethylbutanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2,2-dimethylbutanoate
MOLECULAR FORMULA: C20H22O3
MOLECULAR WEIGHT: 310.38688
SMILES: CCC(C)(C)C(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 4376-34-5
CAS Name: 4-methylpentanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-methylpentanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 4-methylpentanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 4-methylpentanoate
MOLECULAR FORMULA: C20H22O3
MOLECULAR WEIGHT: 310.38688
SMILES: CC(C)CCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 4376-33-4
CAS Name: hexanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] hexanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] hexanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] hexanoate
MOLECULAR FORMULA: C20H22O3
MOLECULAR WEIGHT: 310.38688
SMILES: CCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 4376-31-2
CAS Name: pentanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] pentanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] pentanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] pentanoate
MOLECULAR FORMULA: C19H20O3
MOLECULAR WEIGHT: 296.3603
SMILES: CCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 7497-75-8
CAS Name: 1-methyl-4-(4-phenyl-1-cyclopenta-1,3-dienyl)benzene; 1,3,5-trinitrobenzene
OPENEYE Name: 1-methyl-4-(4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
IUPAC Name: 1-methyl-4-(4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
SYSTEMATIC NAME: 1-methyl-4-(4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
MOLECULAR FORMULA: C24H19N3O6
MOLECULAR WEIGHT: 445.42416
SMILES: CC1=CC=C(C=C1)C2=CC=C(C2)C3=CC=CC=C3.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 7497-74-7
CAS Name: 2-hydroxypropanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-hydroxypropanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-hydroxypropanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-oxidanylpropanoate
MOLECULAR FORMULA: C17H16O4
MOLECULAR WEIGHT: 284.30654
SMILES: CC(C(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)O
Structure:
CAS RN: 4376-29-8
CAS Name: propanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] propanoate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] propanoate
MOLECULAR FORMULA: C17H16O3
MOLECULAR WEIGHT: 268.30714
SMILES: CCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Structure:
CAS RN: 7497-72-5
CAS Name: (4-phenyl-1-cyclopenta-1,3-dienyl)benzene; 1,3,5-trinitrobenzene
OPENEYE Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
IUPAC Name: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
SYSTEMATIC NAME: (4-phenylcyclopenta-1,3-dien-1-yl)benzene; 1,3,5-trinitrobenzene
MOLECULAR FORMULA: C23H17N3O6
MOLECULAR WEIGHT: 431.39758
SMILES: C1C(=CC=C1C2=CC=CC=C2)C3=CC=CC=C3.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4376-28-7
CAS Name: 2-chloroacetic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-chloroacetate
IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-chloroacetate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-chloranylethanoate
MOLECULAR FORMULA: C16H13ClO3
MOLECULAR WEIGHT: 288.72562
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)CCl
Structure:
CAS RN: 7497-71-4
CAS Name: acetic acid [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] ester
OPENEYE Name: [2-[4-(4-bromophenyl)phenyl]-2-oxo-ethyl] acetate
IUPAC Name: [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] acetate
SYSTEMATIC NAME: [2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] ethanoate
MOLECULAR FORMULA: C16H13BrO3
MOLECULAR WEIGHT: 333.17662
SMILES: CC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Br
Structure:
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