CAS RN: 5240-65-3
CAS Name: N2,N3-diphenylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-diphenylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-diphenylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-diphenylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C21H20N2O2
MOLECULAR WEIGHT: 332.3957
SMILES: C1C2C=CC1C(C2C(=O)NC3=CC=CC=C3)C(=O)NC4=CC=CC=C4
Structure:
CAS RN: 5602-44-8
CAS Name: N2,N3-bis(phenylmethyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-dibenzylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-dibenzylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-bis(phenylmethyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C23H24N2O2
MOLECULAR WEIGHT: 360.44886
SMILES: C1C2C=CC1C(C2C(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4
Structure:
CAS RN: 10071-64-4
CAS Name: N2,N3-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-diallylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-bis(prop-2-enyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C15H20N2O2
MOLECULAR WEIGHT: 260.3315
SMILES: C=CCNC(=O)C1C2CC(C1C(=O)NCC=C)C=C2
Structure:
CAS RN: 5602-42-6
CAS Name: N2,N3-ditert-butylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-ditert-butylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-ditert-butylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-ditert-butylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C17H28N2O2
MOLECULAR WEIGHT: 292.41642
SMILES: CC(C)(C)NC(=O)C1C2CC(C1C(=O)NC(C)(C)C)C=C2
Structure:
CAS RN: 5602-39-1
CAS Name: N2,N3-dibutylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-dibutylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-dibutylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-dibutylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C17H28N2O2
MOLECULAR WEIGHT: 292.41642
SMILES: CCCCNC(=O)C1C2CC(C1C(=O)NCCCC)C=C2
Structure:
CAS RN: 5602-38-0
CAS Name: N2,N3-di(propan-2-yl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-diisopropylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-di(propan-2-yl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-di(propan-2-yl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C15H24N2O2
MOLECULAR WEIGHT: 264.36326
SMILES: CC(C)NC(=O)C1C2CC(C1C(=O)NC(C)C)C=C2
Structure:
CAS RN: 5240-59-5
CAS Name: N2,N3-dipropylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-dipropylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-dipropylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-dipropylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C15H24N2O2
MOLECULAR WEIGHT: 264.36326
SMILES: CCCNC(=O)C1C2CC(C1C(=O)NCCC)C=C2
Structure:
CAS RN: 5240-55-1
CAS Name: N2,N3-dimethylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: N2,N3-dimethylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: 2-N,3-N-dimethylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: N2,N3-dimethylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C11H16N2O2
MOLECULAR WEIGHT: 208.25694
SMILES: CNC(=O)C1C2CC(C1C(=O)NC)C=C2
Structure:
CAS RN: 32465-43-3
CAS Name: 1,1-dimethyl-4-piperidin-1-iumol
OPENEYE Name: 1,1-dimethylpiperidin-1-ium-4-ol
IUPAC Name: 1,1-dimethylpiperidin-1-ium-4-ol
SYSTEMATIC NAME: 1,1-dimethylpiperidin-1-ium-4-ol
MOLECULAR FORMULA: C7H16NO+
MOLECULAR WEIGHT: 130.20804
SMILES: C[N+]1(CCC(CC1)O)C
Structure:
CAS RN: 7058-95-9
CAS Name: 2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
OPENEYE Name: 2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
IUPAC Name: 2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
SYSTEMATIC NAME: 2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
MOLECULAR FORMULA: C22H27NO4
MOLECULAR WEIGHT: 369.45408
SMILES: CC1C2=CC(=C(C=C2CC3N1CCC4=CC(=C(C=C34)OC)OC)OC)OC
Structure:
CAS RN: 38199-16-5
CAS Name: (2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-6-yl)methanol
OPENEYE Name: (2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-6-yl)methanol
IUPAC Name: (2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-6-yl)methanol
SYSTEMATIC NAME: (2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-6-yl)methanol
MOLECULAR FORMULA: C14H13NO3
MOLECULAR WEIGHT: 243.25792
SMILES: C1C2=C(C=CC(=N2)CO)OC(O1)C3=CC=CC=C3
Structure:
CAS RN: 31926-65-5
CAS Name: 9H-benzo[f][2]benzothiol-4-one
OPENEYE Name: 9H-benzo[f][2]benzothiol-4-one
IUPAC Name: 9H-benzo[f][2]benzothiol-4-one
SYSTEMATIC NAME: 9H-benzo[f][2]benzothiol-4-one
MOLECULAR FORMULA: C12H8OS
MOLECULAR WEIGHT: 200.25632
SMILES: C1C2=CC=CC=C2C(=O)C3=CSC=C31
Structure:
CAS RN: 24866-72-6
CAS Name: acetic acid [phenyl(pyridin-4-yl)methyl] ester; 2,4,6-trinitrophenol
OPENEYE Name: [phenyl(4-pyridyl)methyl] acetate; picric acid
IUPAC Name: [phenyl(pyridin-4-yl)methyl] acetate; 2,4,6-trinitrophenol
SYSTEMATIC NAME: [phenyl(pyridin-4-yl)methyl] ethanoate; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C20H16N4O9
MOLECULAR WEIGHT: 456.36244
SMILES: CC(=O)OC(C1=CC=CC=C1)C2=CC=NC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 15938-03-1
CAS Name: 2-methylpyridine; 2,4,6-trinitrophenol
OPENEYE Name: 2-methylpyridine; picric acid
IUPAC Name: 2-methylpyridine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 2-methylpyridine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C12H10N4O7
MOLECULAR WEIGHT: 322.2304
SMILES: CC1=CC=CC=N1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4846-51-9
CAS Name: 2,4-dimethylpyridine; 2,4,6-trinitrophenol
OPENEYE Name: 2,4-dimethylpyridine; picric acid
IUPAC Name: 2,4-dimethylpyridine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 2,4-dimethylpyridine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C13H12N4O7
MOLECULAR WEIGHT: 336.25698
SMILES: CC1=CC(=NC=C1)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 87647-06-1
CAS Name: 2-(1-methyl-4-piperidinyl)acetic acid
OPENEYE Name: 2-(1-methyl-4-piperidyl)acetic acid
IUPAC Name: 2-(1-methylpiperidin-4-yl)acetic acid
SYSTEMATIC NAME: 2-(1-methylpiperidin-4-yl)ethanoic acid
MOLECULAR FORMULA: C8H15NO2
MOLECULAR WEIGHT: 157.2102
SMILES: CN1CCC(CC1)CC(=O)O
Structure:
CAS RN: 3069-94-1
CAS Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxopentanoic acid
OPENEYE Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxo-pentanoic acid
IUPAC Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxopentanoic acid
SYSTEMATIC NAME: 2-azanyl-5-[[4-[bis(2-chloroethyl)amino]phenyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C15H21Cl2N3O3
MOLECULAR WEIGHT: 362.25154
SMILES: C1=CC(=CC=C1NC(=O)CCC(C(=O)O)N)N(CCCl)CCCl
Structure:
CAS RN: 3331-00-8
CAS Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxopentanoic acid
OPENEYE Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxo-pentanoic acid
IUPAC Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]anilino]-5-oxopentanoic acid
SYSTEMATIC NAME: 2-azanyl-5-[[4-[bis(2-chloroethyl)amino]phenyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C15H21Cl2N3O3
MOLECULAR WEIGHT: 362.25154
SMILES: C1=CC(=CC=C1NC(=O)CCC(C(=O)O)N)N(CCCl)CCCl
Structure:
CAS RN: 3331-02-0
CAS Name: 2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid ethyl ester
OPENEYE Name: ethyl 2-[(2-amino-3-hydroxy-propanoyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
IUPAC Name: ethyl 2-[(2-amino-3-hydroxypropanoyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
SYSTEMATIC NAME: ethyl 2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
MOLECULAR FORMULA: C18H27Cl2N3O4
MOLECULAR WEIGHT: 420.33068
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)C(CO)N
Structure:
CAS RN: 13331-69-6
CAS Name: 2-[(2-acetamido-1-oxopropyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid ethyl ester
OPENEYE Name: ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
IUPAC Name: ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
SYSTEMATIC NAME: ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
MOLECULAR FORMULA: C20H29Cl2N3O4
MOLECULAR WEIGHT: 446.36796
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)C(C)NC(=O)C
Structure:
CAS RN: 4363-04-6
CAS Name: 6-amino-2-naphthalenol
OPENEYE Name: 6-aminonaphthalen-2-ol
IUPAC Name: 6-aminonaphthalen-2-ol
SYSTEMATIC NAME: 6-azanylnaphthalen-2-ol
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: C1=CC2=C(C=CC(=C2)O)C=C1N
Structure:
CAS RN: 59886-40-7
CAS Name: 2,5-bis(1-aziridinyl)-3,6-bis[4-(2-hydroxyethyl)-1-piperazinyl]cyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 2,5-bis(aziridin-1-yl)-3,6-bis[4-(2-hydroxyethyl)piperazin-1-yl]-1,4-benzoquinone
IUPAC Name: 2,5-bis(aziridin-1-yl)-3,6-bis[4-(2-hydroxyethyl)piperazin-1-yl]cyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,5-bis(aziridin-1-yl)-3,6-bis[4-(2-hydroxyethyl)piperazin-1-yl]cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C22H34N6O4
MOLECULAR WEIGHT: 446.54316
SMILES: C1CN(CCN1CCO)C2=C(C(=O)C(=C(C2=O)N3CC3)N4CCN(CC4)CCO)N5CC5
Structure:
CAS RN: 79692-13-0
CAS Name: N-[5-(diethylamino)pentan-2-yl]-N-[3-(diethylamino)propyl]hexadecanamide
OPENEYE Name: N-[4-(diethylamino)-1-methyl-butyl]-N-[3-(diethylamino)propyl]hexadecanamide
IUPAC Name: N-[5-(diethylamino)pentan-2-yl]-N-[3-(diethylamino)propyl]hexadecanamide
SYSTEMATIC NAME: N-[5-(diethylamino)pentan-2-yl]-N-[3-(diethylamino)propyl]hexadecanamide
MOLECULAR FORMULA: C32H67N3O
MOLECULAR WEIGHT: 509.89388
SMILES: CCCCCCCCCCCCCCCC(=O)N(CCCN(CC)CC)C(C)CCCN(CC)CC
Structure:
CAS RN: 61018-01-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H30N2O3
MOLECULAR WEIGHT: 358.4745
SMILES: CCC1C2CC3C4C5(CC(C2C5O)N3C1O)C6=CC=CC=C6N4C.CO
Structure:
CAS RN: 53683-73-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H34O9
MOLECULAR WEIGHT: 478.53206
SMILES: CCC(C)C(=O)OC1C2C(C(C3(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
Structure:
CAS RN: 28871-80-9
CAS Name: bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
OPENEYE Name: bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
IUPAC Name: bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
SYSTEMATIC NAME: bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
MOLECULAR FORMULA: C10H12O4
MOLECULAR WEIGHT: 196.19988
SMILES: C1CC2C=CC1C(C2C(=O)O)C(=O)O
Structure:
CAS RN: 14805-29-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H11NO2
MOLECULAR WEIGHT: 165.18914
SMILES: C1CC2CC1C3C2C(=O)NC3=O
Structure:
CAS RN: 84309-85-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H19NO3
MOLECULAR WEIGHT: 237.29486
SMILES: CCN(CC)C(=O)C1C2CC3C1C(=O)OC3C2
Structure:
CAS RN: 33140-59-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H6Br2O3
MOLECULAR WEIGHT: 321.95014
SMILES: C1C2C=CC1C3(C2(C(=O)OC3=O)Br)Br
Structure:
CAS RN: 5602-35-7
CAS Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
OPENEYE Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
IUPAC Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
SYSTEMATIC NAME: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
MOLECULAR FORMULA: C9H12N2O2
MOLECULAR WEIGHT: 180.20378
SMILES: C1C2C=CC1C(C2C(=O)N)C(=O)N
Structure:
CAS RN: 28871-71-8
CAS Name: 3-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
OPENEYE Name: 3-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
IUPAC Name: 3-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
SYSTEMATIC NAME: 3-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
MOLECULAR FORMULA: C10H12O4
MOLECULAR WEIGHT: 196.19988
SMILES: CC1(C2CC(C1C(=O)O)C=C2)C(=O)O
Structure:
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