CAS RN: 102395-82-4
CAS Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide dihydrochloride
OPENEYE Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(4-pyridylmethyl)benzenesulfonamide dihydrochloride
IUPAC Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide dihydrochloride
SYSTEMATIC NAME: 4-azanyl-N-[2-(diethylamino)ethyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide dihydrochloride
MOLECULAR FORMULA: C18H28Cl2N4O2S
MOLECULAR WEIGHT: 435.41152
SMILES: CCN(CC)CCN(CC1=CC=NC=C1)S(=O)(=O)C2=CC=C(C=C2)N.Cl.Cl
Structure:
CAS RN: 102395-81-3
CAS Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(3-pyridinylmethyl)benzenesulfonamide dihydrochloride
OPENEYE Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(3-pyridylmethyl)benzenesulfonamide dihydrochloride
IUPAC Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide dihydrochloride
SYSTEMATIC NAME: 4-azanyl-N-[2-(diethylamino)ethyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide dihydrochloride
MOLECULAR FORMULA: C18H28Cl2N4O2S
MOLECULAR WEIGHT: 435.41152
SMILES: CCN(CC)CCN(CC1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)N.Cl.Cl
Structure:
CAS RN: 102395-80-2
CAS Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(2-pyridinylmethyl)benzenesulfonamide dihydrochloride
OPENEYE Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(2-pyridylmethyl)benzenesulfonamide dihydrochloride
IUPAC Name: 4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-2-ylmethyl)benzenesulfonamide dihydrochloride
SYSTEMATIC NAME: 4-azanyl-N-[2-(diethylamino)ethyl]-N-(pyridin-2-ylmethyl)benzenesulfonamide dihydrochloride
MOLECULAR FORMULA: C18H28Cl2N4O2S
MOLECULAR WEIGHT: 435.41152
SMILES: CCN(CC)CCN(CC1=CC=CC=N1)S(=O)(=O)C2=CC=C(C=C2)N.Cl.Cl
Structure:
CAS RN: 93310-18-0
CAS Name: 1,6-bis[bis(2-chloroethyl)sulfamoylamino]hexane
OPENEYE Name: 1,6-bis[bis(2-chloroethyl)sulfamoylamino]hexane
IUPAC Name: 1,6-bis[bis(2-chloroethyl)sulfamoylamino]hexane
SYSTEMATIC NAME: 1,6-bis[bis(2-chloroethyl)sulfamoylamino]hexane
MOLECULAR FORMULA: C14H30Cl4N4O4S2
MOLECULAR WEIGHT: 524.3544
SMILES: C(CCCNS(=O)(=O)N(CCCl)CCCl)CCNS(=O)(=O)N(CCCl)CCCl
Structure:
CAS RN: 91179-50-9
CAS Name: 1,2-bis[bis(2-chloroethyl)sulfamoylamino]ethane
OPENEYE Name: 1,2-bis[bis(2-chloroethyl)sulfamoylamino]ethane
IUPAC Name: 1,2-bis[bis(2-chloroethyl)sulfamoylamino]ethane
SYSTEMATIC NAME: 1,2-bis[bis(2-chloroethyl)sulfamoylamino]ethane
MOLECULAR FORMULA: C10H22Cl4N4O4S2
MOLECULAR WEIGHT: 468.24808
SMILES: C(CNS(=O)(=O)N(CCCl)CCCl)NS(=O)(=O)N(CCCl)CCCl
Structure:
CAS RN: 102367-23-7
CAS Name: 4-but-3-yn-2-yloxy-4-oxobutanoic acid
OPENEYE Name: 4-(1-methylprop-2-ynoxy)-4-oxo-butanoic acid
IUPAC Name: 4-but-3-yn-2-yloxy-4-oxobutanoic acid
SYSTEMATIC NAME: 4-but-3-yn-2-yloxy-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C8H10O4
MOLECULAR WEIGHT: 170.1626
SMILES: CC(C#C)OC(=O)CCC(=O)O
Structure:
CAS RN: 102367-22-6
CAS Name: sodium 4-oxo-4-pent-1-yn-3-yloxybutanoate
OPENEYE Name: sodium 4-(1-ethylprop-2-ynoxy)-4-oxo-butanoate
IUPAC Name: sodium 4-oxo-4-pent-1-yn-3-yloxybutanoate
SYSTEMATIC NAME: sodium 4-oxidanylidene-4-pent-1-yn-3-yloxy-butanoate
MOLECULAR FORMULA: C9H11NaO4
MOLECULAR WEIGHT: 206.17101
SMILES: CCC(C#C)OC(=O)CCC(=O)[O-].[Na+]
Structure:
CAS RN: 94755-54-1
CAS Name: 2-ethyl-2-phenylbutanedioic acid O4-[2-(diethylamino)ethyl] ester O1-ethyl ester
OPENEYE Name: O4-[2-(diethylamino)ethyl] O1-ethyl 2-ethyl-2-phenyl-butanedioate
IUPAC Name: 4-O-[2-(diethylamino)ethyl] 1-O-ethyl 2-ethyl-2-phenylbutanedioate
SYSTEMATIC NAME: O4-[2-(diethylamino)ethyl] O1-ethyl 2-ethyl-2-phenyl-butanedioate
MOLECULAR FORMULA: C20H31NO4
MOLECULAR WEIGHT: 349.46444
SMILES: CCC(CC(=O)OCCN(CC)CC)(C1=CC=CC=C1)C(=O)OCC
Structure:
CAS RN: 102367-21-5
CAS Name: sodium 4-(3-methylpent-1-yn-3-yloxy)-4-oxobutanoate
OPENEYE Name: sodium 4-(1-ethyl-1-methyl-prop-2-ynoxy)-4-oxo-butanoate
IUPAC Name: sodium 4-(3-methylpent-1-yn-3-yloxy)-4-oxobutanoate
SYSTEMATIC NAME: sodium 4-(3-methylpent-1-yn-3-yloxy)-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C10H13NaO4
MOLECULAR WEIGHT: 220.19759
SMILES: CCC(C)(C#C)OC(=O)CCC(=O)[O-].[Na+]
Structure:
CAS RN: 102367-20-4
CAS Name: 4-[cyclopentyl(phenyl)methoxy]-4-oxobutanoic acid
OPENEYE Name: 4-[cyclopentyl(phenyl)methoxy]-4-oxo-butanoic acid
IUPAC Name: 4-[cyclopentyl(phenyl)methoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[cyclopentyl(phenyl)methoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C16H20O4
MOLECULAR WEIGHT: 276.3276
SMILES: C1CCC(C1)C(C2=CC=CC=C2)OC(=O)CCC(=O)O
Structure:
CAS RN: 97492-92-7
CAS Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxobutanoic acid
OPENEYE Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxo-butanoic acid
IUPAC Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[1-(4-chlorophenyl)hexoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C16H21ClO4
MOLECULAR WEIGHT: 312.78854
SMILES: CCCCCC(C1=CC=C(C=C1)Cl)OC(=O)CCC(=O)O
Structure:
CAS RN: 97492-93-8
CAS Name: 4-[1-(4-chlorophenyl)-4-methylpentoxy]-4-oxobutanoic acid
OPENEYE Name: 4-[1-(4-chlorophenyl)-4-methyl-pentoxy]-4-oxo-butanoic acid
IUPAC Name: 4-[1-(4-chlorophenyl)-4-methylpentoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[1-(4-chlorophenyl)-4-methyl-pentoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C16H21ClO4
MOLECULAR WEIGHT: 312.78854
SMILES: CC(C)CCC(C1=CC=C(C=C1)Cl)OC(=O)CCC(=O)O
Structure:
CAS RN: 102367-19-1
CAS Name: sodium 4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
OPENEYE Name: sodium 4-tert-butoxy-4-oxo-butanoate
IUPAC Name: sodium 4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate
SYSTEMATIC NAME: sodium 4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C8H13NaO4
MOLECULAR WEIGHT: 196.17619
SMILES: CC(C)(C)OC(=O)CCC(=O)[O-].[Na+]
Structure:
CAS RN: 102367-17-9
CAS Name: N-hydroxy-N-methoxy-4-oxobutanamide
OPENEYE Name: N-hydroxy-N-methoxy-4-oxo-butanamide
IUPAC Name: N-hydroxy-N-methoxy-4-oxobutanamide
SYSTEMATIC NAME: N-methoxy-N-oxidanyl-4-oxidanylidene-butanamide
MOLECULAR FORMULA: C5H9NO4
MOLECULAR WEIGHT: 147.12926
SMILES: CON(C(=O)CCC=O)O
Structure:
CAS RN: 11005-63-3
CAS Name: (14R)-5,14-dihydroxy-3-[[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy-2-oxanyl]oxy]-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxald
OPENEYE Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexoxy]tetrahydropyran-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-ca
IUPAC Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyd
SYSTEMATIC NAME: (14R)-3-[(2R,4R,6R)-5-[(1S,2S,3R,4S,5S)-5-(hydroxymethyl)-2,3,4-tris(oxidanyl)cyclohexyl]oxy-4-methoxy-6-methyl-oxan-2-yl]oxy-13-methyl-5,14-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanth
MOLECULAR FORMULA: C37H56O13
MOLECULAR WEIGHT: 708.83274
SMILES: C[C@@H]1C([C@@H](C[C@@H](O1)OC2CCC3(C4CCC5(C(CC[C@]5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O[C@H]7C[C@H]([C@@H]([C@H]([C@@H]7O)O)O)CO
Structure:
CAS RN: 12671-69-1
CAS Name: (14R)-5,14-dihydroxy-3-[[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy-2-oxanyl]oxy]-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxald
OPENEYE Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexoxy]tetrahydropyran-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-ca
IUPAC Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyd
SYSTEMATIC NAME: (14R)-3-[(2R,4R,6R)-5-[(1S,2S,3R,4S,5S)-5-(hydroxymethyl)-2,3,4-tris(oxidanyl)cyclohexyl]oxy-4-methoxy-6-methyl-oxan-2-yl]oxy-13-methyl-5,14-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanth
MOLECULAR FORMULA: C37H56O13
MOLECULAR WEIGHT: 708.83274
SMILES: C[C@@H]1C([C@@H](C[C@@H](O1)OC2CCC3(C4CCC5(C(CC[C@]5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O[C@H]7C[C@H]([C@@H]([C@H]([C@@H]7O)O)O)CO
Structure:
CAS RN: 8001-51-2
CAS Name: (14R)-5,14-dihydroxy-3-[[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy-2-oxanyl]oxy]-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxald
OPENEYE Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexoxy]tetrahydropyran-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-ca
IUPAC Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyd
SYSTEMATIC NAME: (14R)-3-[(2R,4R,6R)-5-[(1S,2S,3R,4S,5S)-5-(hydroxymethyl)-2,3,4-tris(oxidanyl)cyclohexyl]oxy-4-methoxy-6-methyl-oxan-2-yl]oxy-13-methyl-5,14-bis(oxidanyl)-17-(5-oxidanylidene-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanth
MOLECULAR FORMULA: C37H56O13
MOLECULAR WEIGHT: 708.83274
SMILES: C[C@@H]1C([C@@H](C[C@@H](O1)OC2CCC3(C4CCC5(C(CC[C@]5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O[C@H]7C[C@H]([C@@H]([C@H]([C@@H]7O)O)O)CO
Structure:
CAS RN: 93651-83-3
CAS Name: 4-[(Z)-2-(4-hydroxyphenyl)pent-1-enyl]phenol
OPENEYE Name: 4-[(Z)-2-(4-hydroxyphenyl)pent-1-enyl]phenol
IUPAC Name: 4-[(Z)-2-(4-hydroxyphenyl)pent-1-enyl]phenol
SYSTEMATIC NAME: 4-[(Z)-2-(4-hydroxyphenyl)pent-1-enyl]phenol
MOLECULAR FORMULA: C17H18O2
MOLECULAR WEIGHT: 254.32362
SMILES: CCC/C(=C/C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O
Structure:
CAS RN: 102584-76-9
CAS Name: N-(2-chloroethyl)sulfamic acid 2-chloroethyl ester; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
OPENEYE Name: 2-chloroethyl N-(2-chloroethyl)sulfamate; 4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenol
IUPAC Name: 2-chloroethyl N-(2-chloroethyl)sulfamate; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
SYSTEMATIC NAME: 2-chloroethyl N-(2-chloroethyl)sulfamate; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
MOLECULAR FORMULA: C26H38Cl4N2O8S2
MOLECULAR WEIGHT: 712.53052
SMILES: CC/C(=C(/CC)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O.C(CCl)NS(=O)(=O)OCCCl.C(CCl)NS(=O)(=O)OCCCl
Structure:
CAS RN: 100018-96-0
CAS Name: 18-iodooctadecanoic acid ethyl ester
OPENEYE Name: ethyl 18-iodooctadecanoate
IUPAC Name: ethyl 18-iodooctadecanoate
SYSTEMATIC NAME: ethyl 18-iodanyloctadecanoate
MOLECULAR FORMULA: C20H39IO2
MOLECULAR WEIGHT: 438.42693
SMILES: CCOC(=O)CCCCCCCCCCCCCCCCCI
Structure:
CAS RN: 12322-85-9
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 12447-40-4
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 1344-90-7
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 61028-24-8
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 71377-02-1
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 910783-71-0
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 950582-60-2
CAS Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
OPENEYE Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxy-borinate
IUPAC Name: disodium [oxido(oxoboranyloxy)boranyl]oxy-oxoboranyloxyborinate
SYSTEMATIC NAME: disodium [oxidanidyl(oxidanylideneboranyloxy)boranyl]oxy-oxidanylideneboranyloxy-borinate
MOLECULAR FORMULA: B4Na2O7
MOLECULAR WEIGHT: 201.21934
SMILES: B(=O)OB([O-])OB([O-])OB=O.[Na+].[Na+]
Structure:
CAS RN: 77739-16-3
CAS Name: (2S)-2-[[2-[[(2S)-2-[[(3S)-3-[[2-[[2-[[(2S)-2-[[(2R)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-4-[[(1S)-1-carboxyethyl]amino]-1,4-dioxobutyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxoethyl]amino]pen
OPENEYE Name: (2S)-2-[[2-[[(2S)-2-[[(3S)-3-[[2-[[2-[[(2S)-2-[[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]-4-[[(1S)-1-carboxyethyl]amino]-4-oxo-butanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]pentanedioic acid
IUPAC Name: (2S)-2-[[2-[[(2S)-2-[[(3S)-3-[[2-[[2-[[(2S)-2-[[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]-4-[[(1S)-1-carboxyethyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[2-[[(2S)-2-[[(3S)-3-[2-[2-[[(2S)-2-[[(2R)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]ethanoylamino]ethanoylamino]-4-oxidanylidene-4-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoyl]amino]-3-oxidanyl-propanoyl]amino]ethan
MOLECULAR FORMULA: C35H48N10O15
MOLECULAR WEIGHT: 848.81362
SMILES: C[C@@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H](CC1=CNC2=CC=CC=C21)N
Structure:
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