CAS RN: 123774-75-4
CAS Name: 2-(aminomethyl)-4-cyclohexylphenol
OPENEYE Name: 2-(aminomethyl)-4-cyclohexyl-phenol
IUPAC Name: 2-(aminomethyl)-4-cyclohexylphenol
SYSTEMATIC NAME: 2-(aminomethyl)-4-cyclohexyl-phenol
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: C1CCC(CC1)C2=CC(=C(C=C2)O)CN
Structure:
CAS RN: 123774-74-3
CAS Name: 2-(aminomethyl)-4-phenylphenol
OPENEYE Name: 2-(aminomethyl)-4-phenyl-phenol
IUPAC Name: 2-(aminomethyl)-4-phenylphenol
SYSTEMATIC NAME: 2-(aminomethyl)-4-phenyl-phenol
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)O)CN
Structure:
CAS RN: 108114-93-8
CAS Name: 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
OPENEYE Name: 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
IUPAC Name: 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
SYSTEMATIC NAME: 2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)aniline
MOLECULAR FORMULA: C12H16N2
MOLECULAR WEIGHT: 188.26884
SMILES: CN1CCC(=CC1)C2=CC=CC=C2N
Structure:
CAS RN: 123774-73-2
CAS Name: (2R)-6-amino-2-(N-[(2S)-2-amino-4-carboxy-1-oxobutyl]anilino)-2,3,3-trinitrohexanoic acid
OPENEYE Name: (2R)-6-amino-2-(N-[(2S)-2-amino-4-carboxy-butanoyl]anilino)-2,3,3-trinitro-hexanoic acid
IUPAC Name: (2R)-6-amino-2-(N-[(2S)-2-amino-4-carboxybutanoyl]anilino)-2,3,3-trinitrohexanoic acid
SYSTEMATIC NAME: (2R)-6-azanyl-2-[[(2S)-2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]-phenyl-amino]-2,3,3-trinitro-hexanoic acid
MOLECULAR FORMULA: C17H22N6O11
MOLECULAR WEIGHT: 486.39018
SMILES: C1=CC=C(C=C1)N(C(=O)[C@H](CCC(=O)O)N)[C@](C(=O)O)(C(CCCN)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 123752-07-8
CAS Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal
OPENEYE Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal
IUPAC Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal
SYSTEMATIC NAME: 4-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)butanal
MOLECULAR FORMULA: C9H11N5O2
MOLECULAR WEIGHT: 221.21594
SMILES: C1=NC2=C(N1CCCC=O)C(=O)N=C(N2)N
Structure:
CAS RN: 123731-09-9
CAS Name: ethyl-(3-hydroxypropyl)-dimethylammonium
OPENEYE Name: ethyl-(3-hydroxypropyl)-dimethyl-ammonium
IUPAC Name: ethyl-(3-hydroxypropyl)-dimethylazanium
SYSTEMATIC NAME: ethyl-dimethyl-(3-oxidanylpropyl)azanium
MOLECULAR FORMULA: C7H18NO+
MOLECULAR WEIGHT: 132.22392
SMILES: CC[N+](C)(C)CCCO
Structure:
CAS RN: 108093-87-4
CAS Name: (3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxoethyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-(methylthio)-1-oxobutyl]amino]-4-[[(2S)-1-(carboxymethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
OPENEYE Name: (3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-[[(1S)-1-benzyl-2-(carboxymethylamino)-2-oxo-ethyl]amino]-4-oxo-butanoic acid
IUPAC Name: (3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-[[(2S)-1-(carboxymethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: (3S)-3-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanoylamino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-[[(2S)-1-(2-hydroxy-2-oxoethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanyli
MOLECULAR FORMULA: C42H50N8O11S
MOLECULAR WEIGHT: 874.9584
SMILES: CSCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)O)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)CNC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:
CAS RN: 123731-03-3
CAS Name: [(2R)-2-(1-oxodecoxy)-3-(1-oxooctadecoxy)propyl] 3-(trimethylammonio)propyl phosphate
OPENEYE Name: [(2R)-2-decanoyloxy-3-octadecanoyloxy-propyl] 3-(trimethylammonio)propyl phosphate
IUPAC Name: [(2R)-2-decanoyloxy-3-octadecanoyloxypropyl] 3-(trimethylazaniumyl)propyl phosphate
SYSTEMATIC NAME: [(2R)-2-decanoyloxy-3-octadecanoyloxy-propyl] 3-(trimethylazaniumyl)propyl phosphate
MOLECULAR FORMULA: C37H74NO8P
MOLECULAR WEIGHT: 691.959121
SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCC[N+](C)(C)C)OC(=O)CCCCCCCCC
Structure:
CAS RN: 108089-33-4
CAS Name: 9-acetyl-4,6,9,11-tetrahydroxy-7-[[5-hydroxy-2-(2-hydroxypropyl)-4,10-dimethyl-4,5,6,6a,7,8,10,10a-octahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy]-8,10-dihydro-7H-tetracene-5,12-dione
OPENEYE Name: 9-acetyl-4,6,9,11-tetrahydroxy-7-[[5-hydroxy-2-(2-hydroxypropyl)-4,10-dimethyl-4,5,6,6a,7,8,10,10a-octahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy]-8,10-dihydro-7H-tetracene-5,12-dione
IUPAC Name: 9-acetyl-4,6,9,11-tetrahydroxy-7-[[5-hydroxy-2-(2-hydroxypropyl)-4,10-dimethyl-4,5,6,6a,7,8,10,10a-octahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy]-8,10-dihydro-7H-tetracene-5,12-dione
SYSTEMATIC NAME: 7-[[4,10-dimethyl-5-oxidanyl-2-(2-oxidanylpropyl)-4,5,6,6a,7,8,10,10a-octahydropyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy]-9-ethanoyl-4,6,9,11-tetrakis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione
MOLECULAR FORMULA: C33H39NO13
MOLECULAR WEIGHT: 657.66166
SMILES: CC1C2C(CC(O1)OC3CC(CC4=C(C5=C(C(=C34)O)C(=O)C6=C(C5=O)C=CC=C6O)O)(C(=O)C)O)NC(C(OC(O2)CC(C)O)C)O
Structure:
CAS RN: 123729-01-1
CAS Name: (2S)-2-aminopentanedioic acid bis(3,3-dimethylbutan-2-yl) ester
OPENEYE Name: bis(1,2,2-trimethylpropyl) (2S)-2-aminopentanedioate
IUPAC Name: bis(3,3-dimethylbutan-2-yl) (2S)-2-aminopentanedioate
SYSTEMATIC NAME: bis(3,3-dimethylbutan-2-yl) (2S)-2-azanylpentanedioate
MOLECULAR FORMULA: C17H33NO4
MOLECULAR WEIGHT: 315.44822
SMILES: CC(C(C)(C)C)OC(=O)CC[C@@H](C(=O)OC(C)C(C)(C)C)N
Structure:
CAS RN: 123725-00-8
CAS Name: N-(3-amino-3-iminopropyl)-2-[[(4-formamido-1-methyl-2-pyrrolyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxamide
OPENEYE Name: N-(3-amino-3-imino-propyl)-2-[(4-formamido-1-methyl-pyrrole-2-carbonyl)amino]-4-methyl-thiazole-5-carboxamide
IUPAC Name: N-(3-amino-3-iminopropyl)-2-[(4-formamido-1-methylpyrrole-2-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: N-(3-azanyl-3-azanylidene-propyl)-2-[(4-formamido-1-methyl-pyrrol-2-yl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C15H19N7O3S
MOLECULAR WEIGHT: 377.42146
SMILES: CC1=C(SC(=N1)NC(=O)C2=CC(=CN2C)NC=O)C(=O)NCCC(=N)N
Structure:
CAS RN: 123724-99-2
CAS Name: N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-2-formamido-4-methyl-5-thiazolecarboxamide
OPENEYE Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-formamido-4-methyl-thiazole-5-carboxamide
IUPAC Name: N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-2-formamido-4-methyl-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-formamido-4-methyl-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C15H19N7O3S
MOLECULAR WEIGHT: 377.42146
SMILES: CC1=C(SC(=N1)NC=O)C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C
Structure:
CAS RN: 123724-77-6
CAS Name: N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-2-formamido-4-methyl-5-thiazolecarboxamide hydrochloride
OPENEYE Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-formamido-4-methyl-thiazole-5-carboxamide hydrochloride
IUPAC Name: N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-2-formamido-4-methyl-1,3-thiazole-5-carboxamide hydrochloride
SYSTEMATIC NAME: N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-formamido-4-methyl-1,3-thiazole-5-carboxamide hydrochloride
MOLECULAR FORMULA: C15H20ClN7O3S
MOLECULAR WEIGHT: 413.8824
SMILES: CC1=C(SC(=N1)NC=O)C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C.Cl
Structure:
CAS RN: 123724-12-9
CAS Name: 2-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]quinoline
OPENEYE Name: 2-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]quinoline
IUPAC Name: 2-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]quinoline
SYSTEMATIC NAME: 2-[[3-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenoxy]methyl]quinoline
MOLECULAR FORMULA: C18H15N5O
MOLECULAR WEIGHT: 317.3446
SMILES: C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)CC4=NNN=N4
Structure:
CAS RN: 123723-79-5
CAS Name: (4-iodanylphenyl)-methyl-dipropylammonium
OPENEYE Name: (4-iodanylphenyl)-methyl-dipropyl-ammonium
IUPAC Name: (4-iodanylphenyl)-methyl-dipropylazanium
SYSTEMATIC NAME: (4-iodanylphenyl)-methyl-dipropyl-azanium
MOLECULAR FORMULA: C13H21IN+
MOLECULAR WEIGHT: 322.218664
SMILES: CCC[N+](C)(CCC)C1=CC=C(C=C1)[131I]
Structure:
CAS RN: 123723-78-4
CAS Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethylammonium
OPENEYE Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-ammonium
IUPAC Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethylazanium
SYSTEMATIC NAME: 2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-azanium
MOLECULAR FORMULA: C20H23ClN3O+
MOLECULAR WEIGHT: 356.86912
SMILES: C[N+](C)(C)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3
Structure:
CAS RN: 123723-75-1
CAS Name: 2,3-dihydroxypropyl [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)-2-oxanyl]methyl hydrogen phosphate
OPENEYE Name: 2,3-dihydroxypropyl [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)tetrahydropyran-2-yl]methyl hydrogen phosphate
IUPAC Name: 2,3-dihydroxypropyl [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl hydrogen phosphate
SYSTEMATIC NAME: 2,3-bis(oxidanyl)propyl [(2R,3S,4S,5R,6S)-3,4,5-tris(oxidanyl)-6-(4-oxidanylphenoxy)oxan-2-yl]methyl hydrogen phosphate
MOLECULAR FORMULA: C15H23O12P
MOLECULAR WEIGHT: 426.309681
SMILES: C1=CC(=CC=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COP(=O)(O)OCC(CO)O)O)O)O
Structure:
CAS RN: 108050-23-3
CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile
OPENEYE Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)pentanenitrile
IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile
SYSTEMATIC NAME: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile
MOLECULAR FORMULA: C27H38N2O5
MOLECULAR WEIGHT: 470.60102
SMILES: CC(C)C(CCCNCCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C(=C2)OC)OC)OC
Structure:
CAS RN: 123712-62-9
CAS Name: (2S)-N-[(2S)-2-[[2-[[(2S)-2-benzamido-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]-1-(4-methoxy-2-naphthalenyl)-2-pyrrolidinecarboxamide
OPENEYE Name: (2S)-N-[(2S)-2-[[2-[[(2S)-2-benzamido-5-guanidino-pentanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]-1-(4-methoxy-2-naphthyl)pyrrolidine-2-carboxamide
IUPAC Name: (2S)-N-[(2S)-2-[[2-[[(2S)-2-benzamido-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-3-phenylpropanoyl]-1-(4-methoxynaphthalen-2-yl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[(2S)-2-[2-[[(2S)-2-benzamido-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]-1-(4-methoxynaphthalen-2-yl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C40H46N8O6
MOLECULAR WEIGHT: 734.84324
SMILES: COC1=CC(=CC2=CC=CC=C21)N3CCC[C@H]3C(=O)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)C5=CC=CC=C5
Structure:
CAS RN: 123691-31-6
CAS Name: 3-aminopropyl(hexyl)phosphinic acid
OPENEYE Name: 3-aminopropyl(hexyl)phosphinic acid
IUPAC Name: 3-aminopropyl(hexyl)phosphinic acid
SYSTEMATIC NAME: 3-azanylpropyl(hexyl)phosphinic acid
MOLECULAR FORMULA: C9H22NO2P
MOLECULAR WEIGHT: 207.250241
SMILES: CCCCCCP(=O)(CCCN)O
Structure:
CAS RN: 123691-14-5
CAS Name: 3-aminopropyl(cyclohexylmethyl)phosphinic acid
OPENEYE Name: 3-aminopropyl(cyclohexylmethyl)phosphinic acid
IUPAC Name: 3-aminopropyl(cyclohexylmethyl)phosphinic acid
SYSTEMATIC NAME: 3-azanylpropyl(cyclohexylmethyl)phosphinic acid
MOLECULAR FORMULA: C10H22NO2P
MOLECULAR WEIGHT: 219.260941
SMILES: C1CCC(CC1)CP(=O)(CCCN)O
Structure:
CAS RN: 123690-78-8
CAS Name: 3-aminopropyl(butyl)phosphinic acid
OPENEYE Name: 3-aminopropyl(butyl)phosphinic acid
IUPAC Name: 3-aminopropyl(butyl)phosphinic acid
SYSTEMATIC NAME: 3-azanylpropyl(butyl)phosphinic acid
MOLECULAR FORMULA: C7H18NO2P
MOLECULAR WEIGHT: 179.197081
SMILES: CCCCP(=O)(CCCN)O
Structure:
CAS RN: 145537-81-1
CAS Name: 3-aminopropyl(butyl)phosphinic acid
OPENEYE Name: 3-aminopropyl(butyl)phosphinic acid
IUPAC Name: 3-aminopropyl(butyl)phosphinic acid
SYSTEMATIC NAME: 3-azanylpropyl(butyl)phosphinic acid
MOLECULAR FORMULA: C7H18NO2P
MOLECULAR WEIGHT: 179.197081
SMILES: CCCCP(=O)(CCCN)O
Structure:
CAS RN: 108032-13-9
CAS Name: 4-[(2R)-2,3-bis(1-oxohexadecoxy)propoxy]-4-oxobutanoic acid
OPENEYE Name: 4-[(2R)-2,3-di(hexadecanoyloxy)propoxy]-4-oxo-butanoic acid
IUPAC Name: 4-[(2R)-2,3-di(hexadecanoyloxy)propoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[(2R)-2,3-di(hexadecanoyloxy)propoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C39H72O8
MOLECULAR WEIGHT: 668.98418
SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCC(=O)O)OC(=O)CCCCCCCCCCCCCCC
Structure:
CAS RN: 123689-66-7
CAS Name: (2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-[(2R)-1-oxo-2-(3-phenylpropylamino)propyl]propanamide
OPENEYE Name: (2S)-2-amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-N-[(2R)-2-(3-phenylpropylamino)propanoyl]propanamide
IUPAC Name: (2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-[(2R)-2-(3-phenylpropylamino)propanoyl]propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-3-(2,6-dimethyl-4-oxidanyl-phenyl)-N-[(2R)-2-(3-phenylpropylamino)propanoyl]propanamide
MOLECULAR FORMULA: C23H31N3O3
MOLECULAR WEIGHT: 397.51054
SMILES: CC1=CC(=CC(=C1C[C@@H](C(=O)NC(=O)[C@@H](C)NCCCC2=CC=CC=C2)N)C)O
Structure:
No comments:
Post a Comment