Wednesday, September 26, 2012

http://ChemLookup.com Compounds




CAS RN: 16366-25-9
CAS Name: 2-[2-[(3,4-dichloroanilino)-oxomethyl]phenoxy]acetic acid
OPENEYE Name: 2-[2-[(3,4-dichlorophenyl)carbamoyl]phenoxy]acetic acid
IUPAC Name: 2-[2-[(3,4-dichlorophenyl)carbamoyl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[2-[(3,4-dichlorophenyl)carbamoyl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C15H11Cl2NO4
MOLECULAR WEIGHT: 340.15814
SMILES: C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)OCC(=O)O
Structure:

CAS RN: 16360-46-6
CAS Name: 1-propoxy-2,3-dihydro-1$l^{5}-phosphole 1-oxide
OPENEYE Name: 1-propoxy-2,3-dihydro-1$l^{5}-phosphole 1-oxide
IUPAC Name: 1-propoxy-2,3-dihydro-1$l^{5}-phosphole 1-oxide
SYSTEMATIC NAME: 1-propoxy-2,3-dihydro-1$l^{5}-phosphole 1-oxide
MOLECULAR FORMULA: C7H13O2P
MOLECULAR WEIGHT: 160.150681
SMILES: CCCOP1(=O)CCC=C1
Structure:

CAS RN: 16353-15-4
CAS Name: 2-(2-methyl-4-oxo-3-quinazolinyl)acetohydrazide
OPENEYE Name: 2-(2-methyl-4-oxo-quinazolin-3-yl)acetohydrazide
IUPAC Name: 2-(2-methyl-4-oxoquinazolin-3-yl)acetohydrazide
SYSTEMATIC NAME: 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanehydrazide
MOLECULAR FORMULA: C11H12N4O2
MOLECULAR WEIGHT: 232.23858
SMILES: CC1=NC2=CC=CC=C2C(=O)N1CC(=O)NN
Structure:

CAS RN: 4383-25-9
CAS Name: N-(phenylmethyl)cyclohexanamine
OPENEYE Name: N-benzylcyclohexanamine
IUPAC Name: N-benzylcyclohexanamine
SYSTEMATIC NAME: N-(phenylmethyl)cyclohexanamine
MOLECULAR FORMULA: C13H19N
MOLECULAR WEIGHT: 189.29666
SMILES: C1CCC(CC1)NCC2=CC=CC=C2
Structure:

CAS RN: 16350-96-2
CAS Name: N-(phenylmethyl)cyclohexanamine hydrochloride
OPENEYE Name: N-benzylcyclohexanamine hydrochloride
IUPAC Name: N-benzylcyclohexanamine hydrochloride
SYSTEMATIC NAME: N-(phenylmethyl)cyclohexanamine hydrochloride
MOLECULAR FORMULA: C13H20ClN
MOLECULAR WEIGHT: 225.7576
SMILES: C1CCC(CC1)NCC2=CC=CC=C2.Cl
Structure:

CAS RN: 16347-81-2
CAS Name: 4-oxo-3-quinazolinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 4-oxoquinazoline-3-carboxylate
IUPAC Name: ethyl 4-oxoquinazoline-3-carboxylate
SYSTEMATIC NAME: ethyl 4-oxidanylidenequinazoline-3-carboxylate
MOLECULAR FORMULA: C11H10N2O3
MOLECULAR WEIGHT: 218.2087
SMILES: CCOC(=O)N1C=NC2=CC=CC=C2C1=O
Structure:

CAS RN: 16347-80-1
CAS Name: 4-oxo-3-quinazolinecarboxylic acid methyl ester
OPENEYE Name: methyl 4-oxoquinazoline-3-carboxylate
IUPAC Name: methyl 4-oxoquinazoline-3-carboxylate
SYSTEMATIC NAME: methyl 4-oxidanylidenequinazoline-3-carboxylate
MOLECULAR FORMULA: C10H8N2O3
MOLECULAR WEIGHT: 204.18212
SMILES: COC(=O)N1C=NC2=CC=CC=C2C1=O
Structure:

CAS RN: 16345-01-0
CAS Name: 11-(3,5-diiodo-4-oxo-1-pyridinyl)undecanoic acid
OPENEYE Name: 11-(3,5-diiodo-4-oxo-1-pyridyl)undecanoic acid
IUPAC Name: 11-(3,5-diiodo-4-oxopyridin-1-yl)undecanoic acid
SYSTEMATIC NAME: 11-[3,5-bis(iodanyl)-4-oxidanylidene-pyridin-1-yl]undecanoic acid
MOLECULAR FORMULA: C16H23I2NO3
MOLECULAR WEIGHT: 531.16766
SMILES: C1=C(C(=O)C(=CN1CCCCCCCCCCC(=O)O)I)I
Structure:

CAS RN: 16345-00-9
CAS Name: 8-(3,5-diiodo-4-oxo-1-pyridinyl)octanoic acid
OPENEYE Name: 8-(3,5-diiodo-4-oxo-1-pyridyl)octanoic acid
IUPAC Name: 8-(3,5-diiodo-4-oxopyridin-1-yl)octanoic acid
SYSTEMATIC NAME: 8-[3,5-bis(iodanyl)-4-oxidanylidene-pyridin-1-yl]octanoic acid
MOLECULAR FORMULA: C13H17I2NO3
MOLECULAR WEIGHT: 489.08792
SMILES: C1=C(C(=O)C(=CN1CCCCCCCC(=O)O)I)I
Structure:

CAS RN: 16344-99-3
CAS Name: 6-(3,5-diiodo-4-oxo-1-pyridinyl)hexanoic acid
OPENEYE Name: 6-(3,5-diiodo-4-oxo-1-pyridyl)hexanoic acid
IUPAC Name: 6-(3,5-diiodo-4-oxopyridin-1-yl)hexanoic acid
SYSTEMATIC NAME: 6-[3,5-bis(iodanyl)-4-oxidanylidene-pyridin-1-yl]hexanoic acid
MOLECULAR FORMULA: C11H13I2NO3
MOLECULAR WEIGHT: 461.03476
SMILES: C1=C(C(=O)C(=CN1CCCCCC(=O)O)I)I
Structure:

CAS RN: 16344-98-2
CAS Name: 5-(3,5-diiodo-4-oxo-1-pyridinyl)pentanoic acid
OPENEYE Name: 5-(3,5-diiodo-4-oxo-1-pyridyl)pentanoic acid
IUPAC Name: 5-(3,5-diiodo-4-oxopyridin-1-yl)pentanoic acid
SYSTEMATIC NAME: 5-[3,5-bis(iodanyl)-4-oxidanylidene-pyridin-1-yl]pentanoic acid
MOLECULAR FORMULA: C10H11I2NO3
MOLECULAR WEIGHT: 447.00818
SMILES: C1=C(C(=O)C(=CN1CCCCC(=O)O)I)I
Structure:

CAS RN: 16336-24-6
CAS Name: N-[(4aS,5S,8aR)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]acetamide
OPENEYE Name: N-[(4aS,5S,8aR)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]acetamide
IUPAC Name: N-[(4aS,5S,8aR)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]acetamide
SYSTEMATIC NAME: N-[(4aS,5S,8aR)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]ethanamide
MOLECULAR FORMULA: C12H22N2O
MOLECULAR WEIGHT: 210.31588
SMILES: CC(=O)N[C@H]1CCC[C@@H]2[C@@H]1CCN(C2)C
Structure:

CAS RN: 16310-87-5
CAS Name: (3-fluoro-2-oxopropyl) dihydrogen phosphate
OPENEYE Name: (3-fluoro-2-oxo-propyl) dihydrogen phosphate
IUPAC Name: (3-fluoro-2-oxopropyl) dihydrogen phosphate
SYSTEMATIC NAME: (3-fluoranyl-2-oxidanylidene-propyl) dihydrogen phosphate
MOLECULAR FORMULA: C3H6FO5P
MOLECULAR WEIGHT: 172.048904
SMILES: C(C(=O)CF)OP(=O)(O)O
Structure:

CAS RN: 16307-06-5
CAS Name: N,N-dimethyl-2-[2-[(2-methylphenyl)methyl]-3H-inden-1-yl]ethanamine hydrochloride
OPENEYE Name: N,N-dimethyl-2-[2-(o-tolylmethyl)-3H-inden-1-yl]ethanamine hydrochloride
IUPAC Name: N,N-dimethyl-2-[2-[(2-methylphenyl)methyl]-3H-inden-1-yl]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-2-[2-[(2-methylphenyl)methyl]-3H-inden-1-yl]ethanamine hydrochloride
MOLECULAR FORMULA: C21H26ClN
MOLECULAR WEIGHT: 327.89084
SMILES: CC1=CC=CC=C1CC2=C(C3=CC=CC=C3C2)CCN(C)C.Cl
Structure:

CAS RN: 16307-00-9
CAS Name: N,N-diethyl-2-[2-[[4-(trifluoromethyl)phenyl]methyl]-3H-inden-1-yl]ethanamine; oxalic acid
OPENEYE Name: N,N-diethyl-2-[2-[[4-(trifluoromethyl)phenyl]methyl]-3H-inden-1-yl]ethanamine; oxalic acid
IUPAC Name: N,N-diethyl-2-[2-[[4-(trifluoromethyl)phenyl]methyl]-3H-inden-1-yl]ethanamine; oxalic acid
SYSTEMATIC NAME: N,N-diethyl-2-[2-[[4-(trifluoromethyl)phenyl]methyl]-3H-inden-1-yl]ethanamine; ethanedioic acid
MOLECULAR FORMULA: C25H28F3NO4
MOLECULAR WEIGHT: 463.48933
SMILES: CCN(CC)CCC1=C(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(F)(F)F.C(=O)(C(=O)O)O
Structure:

CAS RN: 16306-99-3
CAS Name: 2-[2-[(4-ethoxyphenyl)methyl]-3H-inden-1-yl]-N,N-diethylethanamine hydrochloride
OPENEYE Name: 2-[2-[(4-ethoxyphenyl)methyl]-3H-inden-1-yl]-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: 2-[2-[(4-ethoxyphenyl)methyl]-3H-inden-1-yl]-N,N-diethylethanamine hydrochloride
SYSTEMATIC NAME: 2-[2-[(4-ethoxyphenyl)methyl]-3H-inden-1-yl]-N,N-diethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C24H32ClNO
MOLECULAR WEIGHT: 385.96998
SMILES: CCN(CC)CCC1=C(CC2=CC=CC=C21)CC3=CC=C(C=C3)OCC.Cl
Structure:

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