CAS RN: 5429-42-5
CAS Name: N-(4-methylphenyl)-2-(1-piperidinyl)acetamide
OPENEYE Name: 2-(1-piperidyl)-N-(p-tolyl)acetamide
IUPAC Name: N-(4-methylphenyl)-2-piperidin-1-ylacetamide
SYSTEMATIC NAME: N-(4-methylphenyl)-2-piperidin-1-yl-ethanamide
MOLECULAR FORMULA: C14H20N2O
MOLECULAR WEIGHT: 232.3214
SMILES: CC1=CC=C(C=C1)NC(=O)CN2CCCCC2
Structure:
CAS RN: 13995-59-0
CAS Name: N-(4-methylphenyl)-2-(1-piperidinyl)acetamide hydrochloride
OPENEYE Name: 2-(1-piperidyl)-N-(p-tolyl)acetamide hydrochloride
IUPAC Name: N-(4-methylphenyl)-2-piperidin-1-ylacetamide hydrochloride
SYSTEMATIC NAME: N-(4-methylphenyl)-2-piperidin-1-yl-ethanamide hydrochloride
MOLECULAR FORMULA: C14H21ClN2O
MOLECULAR WEIGHT: 268.78234
SMILES: CC1=CC=C(C=C1)NC(=O)CN2CCCCC2.Cl
Structure:
CAS RN: 13988-24-4
CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-methyl-3,3-bis(prop-2-enyl)urea
OPENEYE Name: 1,1-diallyl-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-methyl-urea
IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-methyl-3,3-bis(prop-2-enyl)urea
SYSTEMATIC NAME: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-methyl-3,3-bis(prop-2-enyl)urea
MOLECULAR FORMULA: C17H22N2O3
MOLECULAR WEIGHT: 302.36818
SMILES: CN(CC1COC2=CC=CC=C2O1)C(=O)N(CC=C)CC=C
Structure:
CAS RN: 13983-22-7
CAS Name: 5-(chloromethyl)-4-(hydroxymethyl)-2-methyl-3-pyridinol
OPENEYE Name: 5-(chloromethyl)-4-(hydroxymethyl)-2-methyl-pyridin-3-ol
IUPAC Name: 5-(chloromethyl)-4-(hydroxymethyl)-2-methylpyridin-3-ol
SYSTEMATIC NAME: 5-(chloromethyl)-4-(hydroxymethyl)-2-methyl-pyridin-3-ol
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: CC1=NC=C(C(=C1O)CO)CCl
Structure:
CAS RN: 13973-72-3
CAS Name: N-methylcarbamic acid [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] ester
OPENEYE Name: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxy-ethyl] N-methylcarbamate
IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] N-methylcarbamate
SYSTEMATIC NAME: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl] N-methylcarbamate
MOLECULAR FORMULA: C12H15NO5
MOLECULAR WEIGHT: 253.2512
SMILES: CNC(=O)OCC(C1COC2=CC=CC=C2O1)O
Structure:
CAS RN: 13973-71-2
CAS Name: N-prop-2-enylcarbamic acid [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] ester
OPENEYE Name: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxy-ethyl] N-allylcarbamate
IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] N-prop-2-enylcarbamate
SYSTEMATIC NAME: [2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl] N-prop-2-enylcarbamate
MOLECULAR FORMULA: C14H17NO5
MOLECULAR WEIGHT: 279.28848
SMILES: C=CCNC(=O)OCC(C1COC2=CC=CC=C2O1)O
Structure:
CAS RN: 13972-34-4
CAS Name: 2-[4-[2-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-N,N-diethylethanamine hydrochloride
OPENEYE Name: 2-[4-[2-(4-chlorophenyl)-6-methoxy-tetralin-1-yl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: 2-[4-[2-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-N,N-diethylethanamine hydrochloride
SYSTEMATIC NAME: 2-[4-[2-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C29H35Cl2NO2
MOLECULAR WEIGHT: 500.4997
SMILES: CCN(CC)CCOC1=CC=C(C=C1)C2C(CCC3=C2C=CC(=C3)OC)C4=CC=C(C=C4)Cl.Cl
Structure:
CAS RN: 13965-63-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H37NO4
MOLECULAR WEIGHT: 487.62978
SMILES: C[C@@](CCC1=CC=CC=C1)([C@H]2CC34C=C[C@]2([C@H]5[C@@]36CCN([C@@H]4CC7=C6C(=C(C=C7)OC)O5)C)OC)O
Structure:
CAS RN: 13957-27-2
CAS Name: 1-(2-bromoethynyl)-1-cyclohexanol
OPENEYE Name: 1-(2-bromoethynyl)cyclohexanol
IUPAC Name: 1-(2-bromoethynyl)cyclohexan-1-ol
SYSTEMATIC NAME: 1-(2-bromanylethynyl)cyclohexan-1-ol
MOLECULAR FORMULA: C8H11BrO
MOLECULAR WEIGHT: 203.07634
SMILES: C1CCC(CC1)(C#CBr)O
Structure:
CAS RN: 13943-50-5
CAS Name: 2-hydroxyethyl(trimethyl)ammonium; 2-propylpentanoic acid
OPENEYE Name: 2-hydroxyethyl(trimethyl)ammonium; 2-propylpentanoic acid
IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; 2-propylpentanoic acid
SYSTEMATIC NAME: 2-hydroxyethyl(trimethyl)azanium; 2-propylpentanoic acid
MOLECULAR FORMULA: C13H30NO3+
MOLECULAR WEIGHT: 248.3822
SMILES: CCCC(CCC)C(=O)O.C[N+](C)(C)CCO
Structure:
CAS RN: 13941-03-2
CAS Name: 2-ethylpentanamide
OPENEYE Name: 2-ethylpentanamide
IUPAC Name: 2-ethylpentanamide
SYSTEMATIC NAME: 2-ethylpentanamide
MOLECULAR FORMULA: C7H15NO
MOLECULAR WEIGHT: 129.2001
SMILES: CCCC(CC)C(=O)N
Structure:
CAS RN: 13940-16-4
CAS Name: dichloro(diiodo)stannane
OPENEYE Name: dichloro(diiodo)stannane
IUPAC Name: dichloro(diiodo)stannane
SYSTEMATIC NAME: bis(chloranyl)-bis(iodanyl)stannane
MOLECULAR FORMULA: Cl2I2Sn
MOLECULAR WEIGHT: 443.42494
SMILES: Cl[Sn](Cl)(I)I
Structure:
CAS RN: 13935-78-9
CAS Name: 2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride
OPENEYE Name: 2-aminoindan-1-ol hydrochloride
IUPAC Name: 2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride
SYSTEMATIC NAME: 2-azanyl-2,3-dihydro-1H-inden-1-ol hydrochloride
MOLECULAR FORMULA: C9H12ClNO
MOLECULAR WEIGHT: 185.65068
SMILES: C1C(C(C2=CC=CC=C21)O)N.Cl
Structure:
CAS RN: 13922-84-4
CAS Name: 2,4,6-tris(1-aziridinyl)-5-bromopyrimidine
OPENEYE Name: 2,4,6-tris(aziridin-1-yl)-5-bromo-pyrimidine
IUPAC Name: 2,4,6-tris(aziridin-1-yl)-5-bromopyrimidine
SYSTEMATIC NAME: 2,4,6-tris(aziridin-1-yl)-5-bromanyl-pyrimidine
MOLECULAR FORMULA: C10H12BrN5
MOLECULAR WEIGHT: 282.13978
SMILES: C1CN1C2=C(C(=NC(=N2)N3CC3)N4CC4)Br
Structure:
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