CAS RN: 93484-48-1
CAS Name: 3-bromo-2,3-dihydro-1$l^{6}-benzothiepin 1,1-dioxide
OPENEYE Name: 3-bromo-2,3-dihydro-1$l^{6}-benzothiepine 1,1-dioxide
IUPAC Name: 3-bromo-2,3-dihydro-1$l^{6}-benzothiepine 1,1-dioxide
SYSTEMATIC NAME: 3-bromanyl-2,3-dihydro-1$l^{6}-benzothiepine 1,1-dioxide
MOLECULAR FORMULA: C10H9BrO2S
MOLECULAR WEIGHT: 273.14626
SMILES: C1C(C=CC2=CC=CC=C2S1(=O)=O)Br
Structure:
CAS RN: 21609-66-5
CAS Name: 4-bromo-3,4-dihydro-2H-1-benzothiepin-5-one
OPENEYE Name: 4-bromo-3,4-dihydro-2H-1-benzothiepin-5-one
IUPAC Name: 4-bromo-3,4-dihydro-2H-1-benzothiepin-5-one
SYSTEMATIC NAME: 4-bromanyl-3,4-dihydro-2H-1-benzothiepin-5-one
MOLECULAR FORMULA: C10H9BrOS
MOLECULAR WEIGHT: 257.14686
SMILES: C1CSC2=CC=CC=C2C(=O)C1Br
Structure:
CAS RN: 41887-86-9
CAS Name: 1$l^{6}-benzothiepin 1,1-dioxide
OPENEYE Name: 1$l^{6}-benzothiepine 1,1-dioxide
IUPAC Name: 1$l^{6}-benzothiepine 1,1-dioxide
SYSTEMATIC NAME: 1$l^{6}-benzothiepine 1,1-dioxide
MOLECULAR FORMULA: C10H8O2S
MOLECULAR WEIGHT: 192.23432
SMILES: C1=CC=C2C(=C1)C=CC=CS2(=O)=O
Structure:
CAS RN: 19446-96-9
CAS Name: 1,1-dioxo-2,3-dihydro-1-benzothiopyran-4-one
OPENEYE Name: 1,1-dioxo-2,3-dihydrothiochromen-4-one
IUPAC Name: 1,1-dioxo-2,3-dihydrothiochromen-4-one
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-4-one
MOLECULAR FORMULA: C9H8O3S
MOLECULAR WEIGHT: 196.22302
SMILES: C1CS(=O)(=O)C2=CC=CC=C2C1=O
Structure:
CAS RN: 27720-87-2
CAS Name: 3-bromo-1,1-dioxo-2,3-dihydro-1-benzothiopyran-4-one
OPENEYE Name: 3-bromo-1,1-dioxo-2,3-dihydrothiochromen-4-one
IUPAC Name: 3-bromo-1,1-dioxo-2,3-dihydrothiochromen-4-one
SYSTEMATIC NAME: 3-bromanyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-4-one
MOLECULAR FORMULA: C9H7BrO3S
MOLECULAR WEIGHT: 275.11908
SMILES: C1C(C(=O)C2=CC=CC=C2S1(=O)=O)Br
Structure:
CAS RN: 19062-41-0
CAS Name: 2-[bis(prop-2-enyl)amino]-1H-quinazolin-4-one
OPENEYE Name: 2-(diallylamino)-1H-quinazolin-4-one
IUPAC Name: 2-[bis(prop-2-enyl)amino]-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-[bis(prop-2-enyl)amino]-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H15N3O
MOLECULAR WEIGHT: 241.2884
SMILES: C=CCN(CC=C)C1=NC(=O)C2=CC=CC=C2N1
Structure:
CAS RN: 52938-74-6
CAS Name: 2-phenyl-4-(2,4,4-trimethylpentan-2-yl)phenol
OPENEYE Name: 2-phenyl-4-(1,1,3,3-tetramethylbutyl)phenol
IUPAC Name: 2-phenyl-4-(2,4,4-trimethylpentan-2-yl)phenol
SYSTEMATIC NAME: 2-phenyl-4-(2,4,4-trimethylpentan-2-yl)phenol
MOLECULAR FORMULA: C20H26O
MOLECULAR WEIGHT: 282.41984
SMILES: CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)C2=CC=CC=C2
Structure:
CAS RN: 72666-87-6
CAS Name: 3-(3-phenylpropoxy)propylbenzene
OPENEYE Name: 3-(3-phenylpropoxy)propylbenzene
IUPAC Name: 3-(3-phenylpropoxy)propylbenzene
SYSTEMATIC NAME: 3-(3-phenylpropoxy)propylbenzene
MOLECULAR FORMULA: C18H22O
MOLECULAR WEIGHT: 254.36668
SMILES: C1=CC=C(C=C1)CCCOCCCC2=CC=CC=C2
Structure:
CAS RN: 68125-01-9
CAS Name: N-(2-methylpropyl)dodecanamide
OPENEYE Name: N-isobutyldodecanamide
IUPAC Name: N-(2-methylpropyl)dodecanamide
SYSTEMATIC NAME: N-(2-methylpropyl)dodecanamide
MOLECULAR FORMULA: C16H33NO
MOLECULAR WEIGHT: 255.43932
SMILES: CCCCCCCCCCCC(=O)NCC(C)C
Structure:
CAS RN: 55255-91-9
CAS Name: 2-(2-cyclohexylethoxy)ethylcyclohexane
OPENEYE Name: 2-(2-cyclohexylethoxy)ethylcyclohexane
IUPAC Name: 2-(2-cyclohexylethoxy)ethylcyclohexane
SYSTEMATIC NAME: 2-(2-cyclohexylethoxy)ethylcyclohexane
MOLECULAR FORMULA: C16H30O
MOLECULAR WEIGHT: 238.4088
SMILES: C1CCC(CC1)CCOCCC2CCCCC2
Structure:
CAS RN: 63888-93-7
CAS Name: 2-phenylmethoxybenzoic acid ethyl ester
OPENEYE Name: ethyl 2-benzyloxybenzoate
IUPAC Name: ethyl 2-phenylmethoxybenzoate
SYSTEMATIC NAME: ethyl 2-phenylmethoxybenzoate
MOLECULAR FORMULA: C16H16O3
MOLECULAR WEIGHT: 256.29644
SMILES: CCOC(=O)C1=CC=CC=C1OCC2=CC=CC=C2
Structure:
CAS RN: 54932-87-5
CAS Name: 1-tert-butyl-4-(2-methylprop-2-enoxy)benzene
OPENEYE Name: 1-tert-butyl-4-(2-methylallyloxy)benzene
IUPAC Name: 1-tert-butyl-4-(2-methylprop-2-enoxy)benzene
SYSTEMATIC NAME: 1-tert-butyl-4-(2-methylprop-2-enoxy)benzene
MOLECULAR FORMULA: C14H20O
MOLECULAR WEIGHT: 204.308
SMILES: CC(=C)COC1=CC=C(C=C1)C(C)(C)C
Structure:
CAS RN: 39704-93-3
CAS Name: 1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-4-prop-2-enylbenzene
OPENEYE Name: 4-allyl-1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-benzene
IUPAC Name: 1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-4-prop-2-enylbenzene
SYSTEMATIC NAME: 1-[2-(2-chloroethyloxy)ethoxy]-2-methoxy-4-prop-2-enyl-benzene
MOLECULAR FORMULA: C14H19ClO3
MOLECULAR WEIGHT: 270.75186
SMILES: COC1=C(C=CC(=C1)CC=C)OCCOCCCl
Structure:
CAS RN: 5248-91-9
CAS Name: 1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-4-prop-2-enylbenzene
OPENEYE Name: 4-allyl-1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-benzene
IUPAC Name: 1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-4-prop-2-enylbenzene
SYSTEMATIC NAME: 1-[2-(2-chloroethyloxy)ethoxy]-2-methoxy-4-prop-2-enyl-benzene
MOLECULAR FORMULA: C14H19ClO3
MOLECULAR WEIGHT: 270.75186
SMILES: COC1=C(C=CC(=C1)CC=C)OCCOCCCl
Structure:
CAS RN: 54852-73-2
CAS Name: 1-ethoxy-3-phenylbenzene
OPENEYE Name: 1-ethoxy-3-phenyl-benzene
IUPAC Name: 1-ethoxy-3-phenylbenzene
SYSTEMATIC NAME: 1-ethoxy-3-phenyl-benzene
MOLECULAR FORMULA: C14H14O
MOLECULAR WEIGHT: 198.26036
SMILES: CCOC1=CC=CC(=C1)C2=CC=CC=C2
Structure:
CAS RN: 21655-73-2
CAS Name: 1-bromo-4-[1-(4-bromophenyl)-2,2-dichloroethenyl]benzene
OPENEYE Name: 1-bromo-4-[1-(4-bromophenyl)-2,2-dichloro-vinyl]benzene
IUPAC Name: 1-bromo-4-[1-(4-bromophenyl)-2,2-dichloroethenyl]benzene
SYSTEMATIC NAME: 1-bromanyl-4-[1-(4-bromophenyl)-2,2-bis(chloranyl)ethenyl]benzene
MOLECULAR FORMULA: C14H8Br2Cl2
MOLECULAR WEIGHT: 406.92732
SMILES: C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Br)Br
Structure:
CAS RN: 2907-92-8
CAS Name: 2-methylpropane-1,1,3-tricarboxylic acid triethyl ester
OPENEYE Name: triethyl 2-methylpropane-1,1,3-tricarboxylate
IUPAC Name: triethyl 2-methylpropane-1,1,3-tricarboxylate
SYSTEMATIC NAME: triethyl 2-methylpropane-1,1,3-tricarboxylate
MOLECULAR FORMULA: C13H22O6
MOLECULAR WEIGHT: 274.31018
SMILES: CCOC(=O)CC(C)C(C(=O)OCC)C(=O)OCC
Structure:
CAS RN: 20210-99-5
CAS Name: 2-hydroxybenzoic acid 2-(2-ethoxyethoxy)ethyl ester
OPENEYE Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxybenzoate
IUPAC Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxybenzoate
SYSTEMATIC NAME: 2-(2-ethoxyethoxy)ethyl 2-oxidanylbenzoate
MOLECULAR FORMULA: C13H18O5
MOLECULAR WEIGHT: 254.27902
SMILES: CCOCCOCCOC(=O)C1=CC=CC=C1O
Structure:
CAS RN: 16238-16-7
CAS Name: N,N-dipentylacetamide
OPENEYE Name: N,N-dipentylacetamide
IUPAC Name: N,N-dipentylacetamide
SYSTEMATIC NAME: N,N-dipentylethanamide
MOLECULAR FORMULA: C12H25NO
MOLECULAR WEIGHT: 199.333
SMILES: CCCCCN(CCCCC)C(=O)C
Structure:
CAS RN: 2438-99-5
CAS Name: 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
OPENEYE Name: 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
IUPAC Name: 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
SYSTEMATIC NAME: 3,4-bis(chloranyl)-N-(4-nitrophenyl)benzenesulfonamide
MOLECULAR FORMULA: C12H8Cl2N2O4S
MOLECULAR WEIGHT: 347.17392
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-]
Structure:
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