CAS RN: 59863-01-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26N2O
MOLECULAR WEIGHT: 310.43324
SMILES: CC1(C2CCC3(C(C2)C(N1)CC34C(=O)C5=CC=CC=C5N4)C)C
Structure:
CAS RN: 57103-59-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26N2
MOLECULAR WEIGHT: 294.43384
SMILES: CC1(C2CCC3(C(C2)C(N1)CC4=C3NC5=CC=CC=C45)C)C
Structure:
CAS RN: 61133-96-8
CAS Name: 5-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-imidazolecarboxylic acid methyl ester
OPENEYE Name: methyl 5-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]imidazole-4-carboxylate
IUPAC Name: methyl 5-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazole-4-carboxylate
SYSTEMATIC NAME: methyl 5-azanyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]imidazole-4-carboxylate
MOLECULAR FORMULA: C10H15N3O6
MOLECULAR WEIGHT: 273.2426
SMILES: COC(=O)C1=C(N(C=N1)C2C(C(C(O2)CO)O)O)N
Structure:
CAS RN: 69574-17-0
CAS Name: 2-(3,5-dichloro-4-hydroxyphenyl)indene-1,3-dione
OPENEYE Name: 2-(3,5-dichloro-4-hydroxy-phenyl)indane-1,3-dione
IUPAC Name: 2-(3,5-dichloro-4-hydroxyphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]indene-1,3-dione
MOLECULAR FORMULA: C15H8Cl2O3
MOLECULAR WEIGHT: 307.12822
SMILES: C1=CC=C2C(=C1)C(=O)C(C2=O)C3=CC(=C(C(=C3)Cl)O)Cl
Structure:
CAS RN: 69574-16-9
CAS Name: 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)indene-1,3-dione
OPENEYE Name: 2-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)indane-1,3-dione
IUPAC Name: 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)indene-1,3-dione
MOLECULAR FORMULA: C20H20O3
MOLECULAR WEIGHT: 308.371
SMILES: CC1=C(C(=CC(=C1)C2C(=O)C3=CC=CC=C3C2=O)C(C)(C)C)O
Structure:
CAS RN: 38354-24-4
CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)indene-1,3-dione
OPENEYE Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)indane-1,3-dione
IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)indene-1,3-dione
MOLECULAR FORMULA: C23H26O3
MOLECULAR WEIGHT: 350.45074
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 38354-23-3
CAS Name: 2-[4-hydroxy-3,5-di(propan-2-yl)phenyl]indene-1,3-dione
OPENEYE Name: 2-(4-hydroxy-3,5-diisopropyl-phenyl)indane-1,3-dione
IUPAC Name: 2-[4-hydroxy-3,5-di(propan-2-yl)phenyl]indene-1,3-dione
SYSTEMATIC NAME: 2-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]indene-1,3-dione
MOLECULAR FORMULA: C21H22O3
MOLECULAR WEIGHT: 322.39758
SMILES: CC(C)C1=CC(=CC(=C1O)C(C)C)C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 69574-15-8
CAS Name: 2-(3,5-diethyl-4-hydroxyphenyl)indene-1,3-dione
OPENEYE Name: 2-(3,5-diethyl-4-hydroxy-phenyl)indane-1,3-dione
IUPAC Name: 2-(3,5-diethyl-4-hydroxyphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-(3,5-diethyl-4-oxidanyl-phenyl)indene-1,3-dione
MOLECULAR FORMULA: C19H18O3
MOLECULAR WEIGHT: 294.34442
SMILES: CCC1=CC(=CC(=C1O)CC)C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 36749-59-4
CAS Name: 2-(4-hydroxy-3,5-dimethylphenyl)indene-1,3-dione
OPENEYE Name: 2-(4-hydroxy-3,5-dimethyl-phenyl)indane-1,3-dione
IUPAC Name: 2-(4-hydroxy-3,5-dimethylphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-(3,5-dimethyl-4-oxidanyl-phenyl)indene-1,3-dione
MOLECULAR FORMULA: C17H14O3
MOLECULAR WEIGHT: 266.29126
SMILES: CC1=CC(=CC(=C1O)C)C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 78646-58-9
CAS Name: 4-methyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxy]-2H-furan-5-one
OPENEYE Name: 4-methyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxy]-2H-furan-5-one
IUPAC Name: 4-methyl-2-[(4-methyl-5-oxo-2H-furan-2-yl)oxy]-2H-furan-5-one
SYSTEMATIC NAME: 4-methyl-2-[(4-methyl-5-oxidanylidene-2H-furan-2-yl)oxy]-2H-furan-5-one
MOLECULAR FORMULA: C10H10O5
MOLECULAR WEIGHT: 210.1834
SMILES: CC1=CC(OC1=O)OC2C=C(C(=O)O2)C
Structure:
CAS RN: 39256-39-8
CAS Name: 5-butyl-2-(2H-tetrazol-5-yl)pyridine
OPENEYE Name: 5-butyl-2-(2H-tetrazol-5-yl)pyridine
IUPAC Name: 5-butyl-2-(2H-tetrazol-5-yl)pyridine
SYSTEMATIC NAME: 5-butyl-2-(2H-1,2,3,4-tetrazol-5-yl)pyridine
MOLECULAR FORMULA: C10H13N5
MOLECULAR WEIGHT: 203.24372
SMILES: CCCCC1=CN=C(C=C1)C2=NNN=N2
Structure:
CAS RN: 92952-33-5
CAS Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-thiazolecarboxamide
OPENEYE Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]thiazole-4-carboxamide
IUPAC Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-thiazole-4-carboxamide
SYSTEMATIC NAME: 2-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,3-thiazole-4-carboxamide
MOLECULAR FORMULA: C9H12N2O5S
MOLECULAR WEIGHT: 260.26698
SMILES: C1=C(N=C(S1)C2C(C(C(O2)CO)O)O)C(=O)N
Structure:
CAS RN: 92952-40-4
CAS Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-thiazolecarboxamide
OPENEYE Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]thiazole-4-carboxamide
IUPAC Name: 2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-thiazole-4-carboxamide
SYSTEMATIC NAME: 2-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,3-thiazole-4-carboxamide
MOLECULAR FORMULA: C9H12N2O5S
MOLECULAR WEIGHT: 260.26698
SMILES: C1=C(N=C(S1)C2C(C(C(O2)CO)O)O)C(=O)N
Structure:
CAS RN: 39252-35-2
CAS Name: N,N-diethylcarbamodithioic acid (4-hydroxy-3,5-dimethylphenyl)methyl ester
OPENEYE Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl N,N-diethylcarbamodithioate
IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl N,N-diethylcarbamodithioate
SYSTEMATIC NAME: (3,5-dimethyl-4-oxidanyl-phenyl)methyl N,N-diethylcarbamodithioate
MOLECULAR FORMULA: C14H21NOS2
MOLECULAR WEIGHT: 283.45264
SMILES: CCN(CC)C(=S)SCC1=CC(=C(C(=C1)C)O)C
Structure:
CAS RN: 41004-16-4
CAS Name: N-[3-(2-acetamido-1H-imidazol-5-yl)propyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
OPENEYE Name: N-[3-(2-acetamido-1H-imidazol-5-yl)propyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
IUPAC Name: N-[3-(2-acetamido-1H-imidazol-5-yl)propyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
SYSTEMATIC NAME: N-[3-(2-acetamido-1H-imidazol-5-yl)propyl]-4,5-bis(bromanyl)-1H-pyrrole-2-carboxamide
MOLECULAR FORMULA: C13H15Br2N5O2
MOLECULAR WEIGHT: 433.0985
SMILES: CC(=O)NC1=NC=C(N1)CCCNC(=O)C2=CC(=C(N2)Br)Br
Structure:
CAS RN: 58752-34-4
CAS Name: 2-[2-(1H-indol-3-yl)ethyl]-1-oxo-2,7-naphthyridine-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[2-(1H-indol-3-yl)ethyl]-1-oxo-2,7-naphthyridine-3-carboxylate
IUPAC Name: ethyl 2-[2-(1H-indol-3-yl)ethyl]-1-oxo-2,7-naphthyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[2-(1H-indol-3-yl)ethyl]-1-oxidanylidene-2,7-naphthyridine-3-carboxylate
MOLECULAR FORMULA: C21H19N3O3
MOLECULAR WEIGHT: 361.39386
SMILES: CCOC(=O)C1=CC2=C(C=NC=C2)C(=O)N1CCC3=CNC4=CC=CC=C43
Structure:
CAS RN: 57110-41-5
CAS Name: 5-ethenyl-1-oxo-3-pyrano[3,4-c]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-oxo-5-vinyl-pyrano[3,4-c]pyridine-3-carboxylate
IUPAC Name: ethyl 5-ethenyl-1-oxopyrano[3,4-c]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 5-ethenyl-1-oxidanylidene-pyrano[3,4-c]pyridine-3-carboxylate
MOLECULAR FORMULA: C13H11NO4
MOLECULAR WEIGHT: 245.23074
SMILES: CCOC(=O)C1=CC2=C(C=NC=C2C(=O)O1)C=C
Structure:
CAS RN: 60454-99-1
CAS Name: 1-butoxybenzotriazole
OPENEYE Name: 1-butoxybenzotriazole
IUPAC Name: 1-butoxybenzotriazole
SYSTEMATIC NAME: 1-butoxybenzotriazole
MOLECULAR FORMULA: C10H13N3O
MOLECULAR WEIGHT: 191.22972
SMILES: CCCCON1C2=CC=CC=C2N=N1
Structure:
CAS RN: 22713-34-4
CAS Name: 1-methoxybenzotriazole
OPENEYE Name: 1-methoxybenzotriazole
IUPAC Name: 1-methoxybenzotriazole
SYSTEMATIC NAME: 1-methoxybenzotriazole
MOLECULAR FORMULA: C7H7N3O
MOLECULAR WEIGHT: 149.14998
SMILES: CON1C2=CC=CC=C2N=N1
Structure:
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