CAS RN: 857243-06-2
CAS Name: 2-(1-piperidinyl)-1-butanamine
OPENEYE Name: 2-(1-piperidyl)butan-1-amine
IUPAC Name: 2-piperidin-1-ylbutan-1-amine
SYSTEMATIC NAME: 2-piperidin-1-ylbutan-1-amine
MOLECULAR FORMULA: C9H20N2
MOLECULAR WEIGHT: 156.2685
SMILES: CCC(CN)N1CCCCC1
Structure:
CAS RN: 219783-74-1
CAS Name: 2,3-dimethylbenzohydrazide
OPENEYE Name: 2,3-dimethylbenzohydrazide
IUPAC Name: 2,3-dimethylbenzohydrazide
SYSTEMATIC NAME: 2,3-dimethylbenzohydrazide
MOLECULAR FORMULA: C9H12N2O
MOLECULAR WEIGHT: 164.20438
SMILES: CC1=CC=CC(=C1C)C(=O)NN
Structure:
CAS RN: 915923-42-1
CAS Name: 3-[(3,3-dimethyl-1-oxobutyl)amino]benzoic acid
OPENEYE Name: 3-(3,3-dimethylbutanoylamino)benzoic acid
IUPAC Name: 3-(3,3-dimethylbutanoylamino)benzoic acid
SYSTEMATIC NAME: 3-(3,3-dimethylbutanoylamino)benzoic acid
MOLECULAR FORMULA: C13H17NO3
MOLECULAR WEIGHT: 235.27898
SMILES: CC(C)(C)CC(=O)NC1=CC=CC(=C1)C(=O)O
Structure:
CAS RN: 753489-91-7
CAS Name: 2-(1-imidazolyl)propanoic acid
OPENEYE Name: 2-imidazol-1-ylpropanoic acid
IUPAC Name: 2-imidazol-1-ylpropanoic acid
SYSTEMATIC NAME: 2-imidazol-1-ylpropanoic acid
MOLECULAR FORMULA: C6H8N2O2
MOLECULAR WEIGHT: 140.13992
SMILES: CC(C(=O)O)N1C=CN=C1
Structure:
CAS RN: 895367-68-7
CAS Name: 3-chloro-N-[(2-fluorophenyl)methyl]propanamide
OPENEYE Name: 3-chloro-N-[(2-fluorophenyl)methyl]propanamide
IUPAC Name: 3-chloro-N-[(2-fluorophenyl)methyl]propanamide
SYSTEMATIC NAME: 3-chloranyl-N-[(2-fluorophenyl)methyl]propanamide
MOLECULAR FORMULA: C10H11ClFNO
MOLECULAR WEIGHT: 215.651843
SMILES: C1=CC=C(C(=C1)CNC(=O)CCCl)F
Structure:
CAS RN: 19764-60-4
CAS Name: N2,N2-dimethylpentane-1,2-diamine
OPENEYE Name: N2,N2-dimethylpentane-1,2-diamine
IUPAC Name: 2-N,2-N-dimethylpentane-1,2-diamine
SYSTEMATIC NAME: N2,N2-dimethylpentane-1,2-diamine
MOLECULAR FORMULA: C7H18N2
MOLECULAR WEIGHT: 130.23122
SMILES: CCCC(CN)N(C)C
Structure:
CAS RN: 908494-83-7
CAS Name: 3-chloro-N-(5-fluoro-2-methylphenyl)propanamide
OPENEYE Name: 3-chloro-N-(5-fluoro-2-methyl-phenyl)propanamide
IUPAC Name: 3-chloro-N-(5-fluoro-2-methylphenyl)propanamide
SYSTEMATIC NAME: 3-chloranyl-N-(5-fluoranyl-2-methyl-phenyl)propanamide
MOLECULAR FORMULA: C10H11ClFNO
MOLECULAR WEIGHT: 215.651843
SMILES: CC1=C(C=C(C=C1)F)NC(=O)CCCl
Structure:
CAS RN: 176707-77-0
CAS Name: 1-(3-bromophenyl)ethanamine
OPENEYE Name: 1-(3-bromophenyl)ethanamine
IUPAC Name: 1-(3-bromophenyl)ethanamine
SYSTEMATIC NAME: 1-(3-bromophenyl)ethanamine
MOLECULAR FORMULA: C8H10BrN
MOLECULAR WEIGHT: 200.0757
SMILES: CC(C1=CC(=CC=C1)Br)N
Structure:
CAS RN: 148716-35-2
CAS Name: 1-[4-(2-aminoethyl)-1-piperazinyl]ethanone
OPENEYE Name: 1-[4-(2-aminoethyl)piperazin-1-yl]ethanone
IUPAC Name: 1-[4-(2-aminoethyl)piperazin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-(2-azanylethyl)piperazin-1-yl]ethanone
MOLECULAR FORMULA: C8H17N3O
MOLECULAR WEIGHT: 171.24008
SMILES: CC(=O)N1CCN(CC1)CCN
Structure:
CAS RN: 87394-64-7
CAS Name: 2-(1-piperazinyl)-3-pyridinecarboxamide
OPENEYE Name: 2-piperazin-1-ylpyridine-3-carboxamide
IUPAC Name: 2-piperazin-1-ylpyridine-3-carboxamide
SYSTEMATIC NAME: 2-piperazin-1-ylpyridine-3-carboxamide
MOLECULAR FORMULA: C10H14N4O
MOLECULAR WEIGHT: 206.24436
SMILES: C1CN(CCN1)C2=C(C=CC=N2)C(=O)N
Structure:
CAS RN: 884494-85-3
CAS Name: 5-chloro-6-methoxy-3-pyridinecarboxylic acid
OPENEYE Name: 5-chloro-6-methoxy-pyridine-3-carboxylic acid
IUPAC Name: 5-chloro-6-methoxypyridine-3-carboxylic acid
SYSTEMATIC NAME: 5-chloranyl-6-methoxy-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C7H6ClNO3
MOLECULAR WEIGHT: 187.58044
SMILES: COC1=C(C=C(C=N1)C(=O)O)Cl
Structure:
CAS RN: 874830-75-8
CAS Name: 5-bromo-7-fluoro-1H-indole-2,3-dione
OPENEYE Name: 5-bromo-7-fluoro-indoline-2,3-dione
IUPAC Name: 5-bromo-7-fluoro-1H-indole-2,3-dione
SYSTEMATIC NAME: 5-bromanyl-7-fluoranyl-1H-indole-2,3-dione
MOLECULAR FORMULA: C8H3BrFNO2
MOLECULAR WEIGHT: 244.017323
SMILES: C1=C(C=C2C(=C1F)NC(=O)C2=O)Br
Structure:
CAS RN: 901586-50-3
CAS Name: 2-(1,2,4-triazol-1-yl)propanoic acid
OPENEYE Name: 2-(1,2,4-triazol-1-yl)propanoic acid
IUPAC Name: 2-(1,2,4-triazol-1-yl)propanoic acid
SYSTEMATIC NAME: 2-(1,2,4-triazol-1-yl)propanoic acid
MOLECULAR FORMULA: C5H7N3O2
MOLECULAR WEIGHT: 141.12798
SMILES: CC(C(=O)O)N1C=NC=N1
Structure:
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