Thursday, December 29, 2011

http://ChemLookup.com Compounds




CAS RN: 220928-01-8
CAS Name: 3-amino-2-piperidinone
OPENEYE Name: 3-aminopiperidin-2-one
IUPAC Name: 3-aminopiperidin-2-one
SYSTEMATIC NAME: 3-azanylpiperidin-2-one
MOLECULAR FORMULA: C5H10N2O
MOLECULAR WEIGHT: 114.1457
SMILES: C1CC(C(=O)NC1)N
Structure:

CAS RN: 1892-22-4
CAS Name: 3-amino-2-piperidinone
OPENEYE Name: 3-aminopiperidin-2-one
IUPAC Name: 3-aminopiperidin-2-one
SYSTEMATIC NAME: 3-azanylpiperidin-2-one
MOLECULAR FORMULA: C5H10N2O
MOLECULAR WEIGHT: 114.1457
SMILES: C1CC(C(=O)NC1)N
Structure:

CAS RN: 88139-91-7
CAS Name: (5-bromo-2-pyridinyl)methanol
OPENEYE Name: (5-bromo-2-pyridyl)methanol
IUPAC Name: (5-bromopyridin-2-yl)methanol
SYSTEMATIC NAME: (5-bromanylpyridin-2-yl)methanol
MOLECULAR FORMULA: C6H6BrNO
MOLECULAR WEIGHT: 188.02194
SMILES: C1=CC(=NC=C1Br)CO
Structure:

CAS RN: 6300-89-6
CAS Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-pyridinyl)amino]urea
OPENEYE Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-pyridyl)amino]urea
IUPAC Name: 1-(2-methoxyphenyl)-3-[(5-nitropyridin-2-yl)amino]urea
SYSTEMATIC NAME: 1-(2-methoxyphenyl)-3-[(5-nitropyridin-2-yl)amino]urea
MOLECULAR FORMULA: C13H13N5O4
MOLECULAR WEIGHT: 303.27342
SMILES: COC1=CC=CC=C1NC(=O)NNC2=NC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 588678-32-4
CAS Name: 2-(2,4-difluorophenoxy)propanehydrazide
OPENEYE Name: 2-(2,4-difluorophenoxy)propanehydrazide
IUPAC Name: 2-(2,4-difluorophenoxy)propanehydrazide
SYSTEMATIC NAME: 2-[2,4-bis(fluoranyl)phenoxy]propanehydrazide
MOLECULAR FORMULA: C9H10F2N2O2
MOLECULAR WEIGHT: 216.184706
SMILES: CC(C(=O)NN)OC1=C(C=C(C=C1)F)F
Structure:

CAS RN: 74197-88-9
CAS Name: 4-hydroxy-N-[2-[(4-hydroxy-1-sulfanylidenebutyl)amino]ethyl]butanethioamide
OPENEYE Name: 4-hydroxy-N-[2-(4-hydroxybutanethioylamino)ethyl]butanethioamide
IUPAC Name: 4-hydroxy-N-[2-(4-hydroxybutanethioylamino)ethyl]butanethioamide
SYSTEMATIC NAME: 4-oxidanyl-N-[2-(4-oxidanylbutanethioylamino)ethyl]butanethioamide
MOLECULAR FORMULA: C10H20N2O2S2
MOLECULAR WEIGHT: 264.408
SMILES: C(CC(=S)NCCNC(=S)CCCO)CO
Structure:

CAS RN: 28396-34-1
CAS Name: 5-chloro-2-propan-2-yloxybenzaldehyde
OPENEYE Name: 5-chloro-2-isopropoxy-benzaldehyde
IUPAC Name: 5-chloro-2-propan-2-yloxybenzaldehyde
SYSTEMATIC NAME: 5-chloranyl-2-propan-2-yloxy-benzaldehyde
MOLECULAR FORMULA: C10H11ClO2
MOLECULAR WEIGHT: 198.64614
SMILES: CC(C)OC1=C(C=C(C=C1)Cl)C=O
Structure:

CAS RN: 91821-77-1
CAS Name: 2-amino-3-bromo-7-nitro-9-fluorenone
OPENEYE Name: 2-amino-3-bromo-7-nitro-fluoren-9-one
IUPAC Name: 2-amino-3-bromo-7-nitrofluoren-9-one
SYSTEMATIC NAME: 2-azanyl-3-bromanyl-7-nitro-fluoren-9-one
MOLECULAR FORMULA: C13H7BrN2O3
MOLECULAR WEIGHT: 319.11028
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=C(C=C23)Br)N
Structure:

CAS RN: 6327-29-3
CAS Name: 1,3-bis(1-naphthalenylmethylideneamino)thiourea
OPENEYE Name: 1,3-bis(1-naphthylmethyleneamino)thiourea
IUPAC Name: 1,3-bis(naphthalen-1-ylmethylideneamino)thiourea
SYSTEMATIC NAME: 1,3-bis(naphthalen-1-ylmethylideneamino)thiourea
MOLECULAR FORMULA: C23H18N4S
MOLECULAR WEIGHT: 382.48082
SMILES: C1=CC=C2C(=C1)C=CC=C2C=NNC(=S)NN=CC3=CC=CC4=CC=CC=C43
Structure:

CAS RN: 7474-09-1
CAS Name: N-(2,4-dinitroanilino)formamide
OPENEYE Name: N-(2,4-dinitroanilino)formamide
IUPAC Name: N-(2,4-dinitroanilino)formamide
SYSTEMATIC NAME: N-[(2,4-dinitrophenyl)amino]methanamide
MOLECULAR FORMULA: C7H6N4O5
MOLECULAR WEIGHT: 226.14634
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NNC=O
Structure:

CAS RN: 76609-55-7
CAS Name: 1-[(3-methyl-4-phenyl-2-pyridinyl)methylideneamino]-3-[2-(2-pyridinyl)ethyl]thiourea
OPENEYE Name: 1-[(3-methyl-4-phenyl-2-pyridyl)methyleneamino]-3-[2-(2-pyridyl)ethyl]thiourea
IUPAC Name: 1-[(3-methyl-4-phenylpyridin-2-yl)methylideneamino]-3-(2-pyridin-2-ylethyl)thiourea
SYSTEMATIC NAME: 1-[(3-methyl-4-phenyl-pyridin-2-yl)methylideneamino]-3-(2-pyridin-2-ylethyl)thiourea
MOLECULAR FORMULA: C21H21N5S
MOLECULAR WEIGHT: 375.48994
SMILES: CC1=C(C=CN=C1C=NNC(=S)NCCC2=CC=CC=N2)C3=CC=CC=C3
Structure:

CAS RN: 53897-98-6
CAS Name: 5-diazonio-4-methoxy-3-methyl-2-oxo-1,4-dihydropyrimidin-6-olate
OPENEYE Name: 5-diazonio-4-methoxy-3-methyl-2-oxo-1,4-dihydropyrimidin-6-olate
IUPAC Name: 5-diazonio-4-methoxy-3-methyl-2-oxo-1,4-dihydropyrimidin-6-olate
SYSTEMATIC NAME: 5-diazonio-4-methoxy-3-methyl-2-oxidanylidene-1,4-dihydropyrimidin-6-olate
MOLECULAR FORMULA: C6H8N4O3
MOLECULAR WEIGHT: 184.15272
SMILES: CN1C(C(=C(NC1=O)[O-])[N+]#N)OC
Structure:

CAS RN: 72766-30-4
CAS Name: 2-methyl-4,6-dinitro-N-(3-phenylpropyl)-1H-benzimidazol-5-amine
OPENEYE Name: 2-methyl-4,6-dinitro-N-(3-phenylpropyl)-1H-benzimidazol-5-amine
IUPAC Name: 2-methyl-4,6-dinitro-N-(3-phenylpropyl)-1H-benzimidazol-5-amine
SYSTEMATIC NAME: 2-methyl-4,6-dinitro-N-(3-phenylpropyl)-1H-benzimidazol-5-amine
MOLECULAR FORMULA: C17H17N5O4
MOLECULAR WEIGHT: 355.34798
SMILES: CC1=NC2=C(C(=C(C=C2N1)[N+](=O)[O-])NCCCC3=CC=CC=C3)[N+](=O)[O-]
Structure:

CAS RN: 28741-08-4
CAS Name: octylboronic acid
OPENEYE Name: octylboronic acid
IUPAC Name: octylboronic acid
SYSTEMATIC NAME: octylboronic acid
MOLECULAR FORMULA: C8H19BO2
MOLECULAR WEIGHT: 158.04626
SMILES: B(CCCCCCCC)(O)O
Structure:

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