Wednesday, November 30, 2011

http://ChemLookup.com Compounds




CAS RN: 539-57-1
CAS Name: 2-[(5-tetrazolylideneamino)hydrazo]guanidine
OPENEYE Name: 2-[2-(tetrazol-5-ylideneamino)hydrazino]guanidine
IUPAC Name: 2-[2-(tetrazol-5-ylideneamino)hydrazinyl]guanidine
SYSTEMATIC NAME: 2-[2-(1,2,3,4-tetrazol-5-ylideneamino)hydrazinyl]guanidine
MOLECULAR FORMULA: C2H6N10
MOLECULAR WEIGHT: 170.13604
SMILES: C1(=NNNN=C(N)N)N=NN=N1
Structure:

CAS RN: 54060-94-5
CAS Name: N'-anilino-N-phenyliminobenzenecarboximidamide
OPENEYE Name: N'-anilino-N-phenylimino-benzamidine
IUPAC Name: N'-anilino-N-phenyliminobenzenecarboximidamide
SYSTEMATIC NAME: N'-phenylazanyl-N-phenylimino-benzenecarboximidamide
MOLECULAR FORMULA: C19H16N4
MOLECULAR WEIGHT: 300.35714
SMILES: C1=CC=C(C=C1)/C(=N/NC2=CC=CC=C2)/N=NC3=CC=CC=C3
Structure:

CAS RN: 531-12-4
CAS Name: 18-(2-carboxyethyl)-7,12-diethyl-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-carboxylic acid
OPENEYE Name: 18-(2-carboxyethyl)-7,12-diethyl-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-carboxylic acid
IUPAC Name: 18-(2-carboxyethyl)-7,12-diethyl-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-carboxylic acid
SYSTEMATIC NAME: 7,12-diethyl-18-(3-hydroxy-3-oxopropyl)-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-carboxylic acid
MOLECULAR FORMULA: C32H34N4O4
MOLECULAR WEIGHT: 538.63676
SMILES: CCC1=C2C=C3C(=C(C(=CC4=NC(=CC5=NC(=CC(=C1C)N2)C(=C5C)CC)C(=C4CCC(=O)O)C)N3)C(=O)O)C
Structure:

CAS RN: 21090-68-6
CAS Name: (2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-ol
OPENEYE Name: (2R)-2-isopropenyl-5-methyl-hex-4-en-1-ol
IUPAC Name: (2R)-5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
SYSTEMATIC NAME: (2R)-5-methyl-2-prop-1-en-2-yl-hex-4-en-1-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(=CC[C@@H](CO)C(=C)C)C
Structure:

CAS RN: 498-16-8
CAS Name: (2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-ol
OPENEYE Name: (2R)-2-isopropenyl-5-methyl-hex-4-en-1-ol
IUPAC Name: (2R)-5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
SYSTEMATIC NAME: (2R)-5-methyl-2-prop-1-en-2-yl-hex-4-en-1-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(=CC[C@@H](CO)C(=C)C)C
Structure:

CAS RN: 489-49-6
CAS Name: 4-(ethoxymethyl)-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid
OPENEYE Name: 4-(ethoxymethyl)-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxo-benzo[b][1,4]benzodioxepine-2-carboxylic acid
IUPAC Name: 4-(ethoxymethyl)-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid
SYSTEMATIC NAME: 4-(ethoxymethyl)-10-methanoyl-1,7-dimethyl-3,9-bis(oxidanyl)-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylic acid
MOLECULAR FORMULA: C20H18O9
MOLECULAR WEIGHT: 402.35152
SMILES: CCOCC1=C(C(=C(C2=C1OC(=O)C3=C(O2)C(=C(C=C3C)O)C=O)C)C(=O)O)O
Structure:

CAS RN: 21330-18-7
CAS Name: fluoroaluminum
OPENEYE Name: fluoroaluminum
IUPAC Name: fluoroaluminum
SYSTEMATIC NAME: fluoranylaluminum
MOLECULAR FORMULA: AlF
MOLECULAR WEIGHT: 45.979941
SMILES: F[Al]
Structure:

CAS RN: 59600-76-9
CAS Name: 2-[[(E)-[(Z)-(6-oxo-3-sulfo-1-cyclohexa-2,4-dienylidene)hydrazinylidene]-phenylmethyl]hydrazo]benzoic acid
OPENEYE Name: 2-[2-[(E)-N-[(Z)-(6-oxo-3-sulfo-cyclohexa-2,4-dien-1-ylidene)amino]-C-phenyl-carbonimidoyl]hydrazino]benzoic acid
IUPAC Name: 2-[2-[(E)-N-[(Z)-(6-oxo-3-sulfocyclohexa-2,4-dien-1-ylidene)amino]-C-phenylcarbonimidoyl]hydrazinyl]benzoic acid
SYSTEMATIC NAME: 2-[2-[(E)-N-[(Z)-(6-oxidanylidene-3-sulfo-cyclohexa-2,4-dien-1-ylidene)amino]-C-phenyl-carbonimidoyl]hydrazinyl]benzoic acid
MOLECULAR FORMULA: C20H16N4O6S
MOLECULAR WEIGHT: 440.42924
SMILES: C1=CC=C(C=C1)/C(=N\N=C/2\C=C(C=CC2=O)S(=O)(=O)O)/NNC3=CC=CC=C3C(=O)O
Structure:

CAS RN: 135-11-5
CAS Name: 4-(4-aminoanilino)-3-nitrobenzenesulfonic acid
OPENEYE Name: 4-(4-aminoanilino)-3-nitro-benzenesulfonic acid
IUPAC Name: 4-(4-aminoanilino)-3-nitrobenzenesulfonic acid
SYSTEMATIC NAME: 4-[(4-aminophenyl)amino]-3-nitro-benzenesulfonic acid
MOLECULAR FORMULA: C12H11N3O5S
MOLECULAR WEIGHT: 309.29784
SMILES: C1=CC(=CC=C1N)NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-]
Structure:

CAS RN: 129-54-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H14N4O2
MOLECULAR WEIGHT: 438.43636
SMILES: C1=CC=C2C(=C1)C3=NNC4=C(C=CC(=C43)C2=O)C5=C6C7=C(C=C5)C(=O)C8=CC=CC=C8C7=NN6
Structure:

CAS RN: 128-88-1
CAS Name: 1-nitro-4-[(4-nitro-9,10-dioxo-1-anthracenyl)amino]anthracene-9,10-dione
OPENEYE Name: 1-nitro-4-[(4-nitro-9,10-dioxo-1-anthryl)amino]anthracene-9,10-dione
IUPAC Name: 1-nitro-4-[(4-nitro-9,10-dioxoanthracen-1-yl)amino]anthracene-9,10-dione
SYSTEMATIC NAME: 1-nitro-4-[[4-nitro-9,10-bis(oxidanylidene)anthracen-1-yl]amino]anthracene-9,10-dione
MOLECULAR FORMULA: C28H13N3O8
MOLECULAR WEIGHT: 519.41812
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])NC4=C5C(=C(C=C4)[N+](=O)[O-])C(=O)C6=CC=CC=C6C5=O
Structure:

CAS RN: 85503-67-9
CAS Name: 1-nitro-4-[(4-nitro-9,10-dioxo-1-anthracenyl)amino]anthracene-9,10-dione
OPENEYE Name: 1-nitro-4-[(4-nitro-9,10-dioxo-1-anthryl)amino]anthracene-9,10-dione
IUPAC Name: 1-nitro-4-[(4-nitro-9,10-dioxoanthracen-1-yl)amino]anthracene-9,10-dione
SYSTEMATIC NAME: 1-nitro-4-[[4-nitro-9,10-bis(oxidanylidene)anthracen-1-yl]amino]anthracene-9,10-dione
MOLECULAR FORMULA: C28H13N3O8
MOLECULAR WEIGHT: 519.41812
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])NC4=C5C(=C(C=C4)[N+](=O)[O-])C(=O)C6=CC=CC=C6C5=O
Structure:

CAS RN: 120-70-7
CAS Name: (6Z)-6-[[3-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]propylamino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-[[3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-[[3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[[3-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C17H18N2O2
MOLECULAR WEIGHT: 282.33702
SMILES: C1=C/C(=C\NCCCN/C=C\2/C=CC=CC2=O)/C(=O)C=C1
Structure:

CAS RN: 116-70-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H17NO2
MOLECULAR WEIGHT: 471.50428
SMILES: C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C(C=C7C8=CC=CC=C8C(=O)C9=C7C6=C5C=C9)N)C2=O
Structure:

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