CAS RN: 85204-21-3
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-4-(2-ethylhexylamino)-4-oxo-2-butenoic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-4-(2-ethylhexylamino)-4-oxo-but-2-enoic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-4-(2-ethylhexylamino)-4-oxobut-2-enoic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; (Z)-4-(2-ethylhexylamino)-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C18H36N2O6
MOLECULAR WEIGHT: 376.48824
SMILES: CCCCC(CC)CNC(=O)/C=C\C(=O)O.C(CO)N(CCO)CCO
Structure:
CAS RN: 85005-72-7
CAS Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]-1-naphthalenylidene]-phenylammonium; (Z)-9-octadecenoate
OPENEYE Name: [4-[bis[4-(dimethylamino)phenyl]methylene]-1-naphthylidene]-phenyl-ammonium; (Z)-octadec-9-enoate
IUPAC Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]naphthalen-1-ylidene]-phenylazanium; (Z)-octadec-9-enoate
SYSTEMATIC NAME: [4-[bis[4-(dimethylamino)phenyl]methylidene]naphthalen-1-ylidene]-phenyl-azanium; (Z)-octadec-9-enoate
MOLECULAR FORMULA: C51H65N3O2
MOLECULAR WEIGHT: 752.0807
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[NH+]C3=CC=CC=C3)C4=CC=CC=C24)C5=CC=C(C=C5)N(C)C
Structure:
CAS RN: 84777-85-5
CAS Name: (E)-4-[(2-hydroxy-5-oxo-1-cyclopentenyl)amino]-4-oxo-2-butenoic acid [(2R,4R,5S,6R)-2-[(2S,3R,4S)-4-[(3S,4Z,6Z,9R,10S,11S,12R,13R,14Z,16E)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hy
OPENEYE Name: [(2R,4R,5S,6R)-2-[(1S,2R,3S)-3-[(3S,4Z,6Z,9R,10S,11S,12R,13R,14Z,16E)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-2-hydroxy-1-methyl-butyl]-2-hydroxy-5-methyl-6-[(Z)-prop-1-enyl]tetrahydr
IUPAC Name: [(2R,4R,5S,6R)-2-[(2S,3R,4S)-4-[(3S,4Z,6Z,9R,10S,11S,12R,13R,14Z,16E)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hydroxypentan-2-yl]-2-hydroxy-5-methyl-6-[(Z)-prop-1-enyl]oxan-4-yl] (E
SYSTEMATIC NAME: [(2R,4R,5S,6R)-2-[(2S,3R,4S)-4-[(3S,4Z,6Z,9R,10S,11S,12R,13R,14Z,16E)-11-ethyl-3,17-dimethoxy-7,9,13,15-tetramethyl-10,12-bis(oxidanyl)-18-oxidanylidene-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-oxidanyl-pentan-2-yl]-5-methyl-2-oxidanyl-6-[(Z)-prop-1-e
MOLECULAR FORMULA: C48H71NO14
MOLECULAR WEIGHT: 886.07564
SMILES: CC[C@H]1[C@H]([C@@H](C/C(=C\C=C/[C@@H](C(OC(=O)/C(=C\C(=C/[C@H]([C@H]1O)C)\C)/OC)[C@@H](C)[C@H]([C@H](C)[C@]2(C[C@H]([C@@H]([C@H](O2)/C=C\C)C)OC(=O)/C=C/C(=O)NC3=C(CCC3=O)O)O)O)OC)/C)C)O
Structure:
CAS RN: 84132-11-6
CAS Name: (E)-2-butenedioic acid; 1-[4-(diphenylmethyl)-1-piperidinyl]-N-octylmethanimine
OPENEYE Name: 1-(4-benzhydryl-1-piperidyl)-N-octyl-methanimine; fumaric acid
IUPAC Name: 1-(4-benzhydrylpiperidin-1-yl)-N-octylmethanimine; (E)-but-2-enedioic acid
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-[4-(diphenylmethyl)piperidin-1-yl]-N-octyl-methanimine
MOLECULAR FORMULA: C31H42N2O4
MOLECULAR WEIGHT: 506.67618
SMILES: CCCCCCCCN=CN1CCC(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 83968-31-4
CAS Name: N,N-dimethylaniline; formaldehyde; N-methylaniline; (Z)-9-octadecenoic acid
OPENEYE Name: N,N-dimethylaniline; formaldehyde; N-methylaniline; (Z)-octadec-9-enoic acid
IUPAC Name: N,N-dimethylaniline; formaldehyde; N-methylaniline; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: N,N-dimethylaniline; methanal; N-methylaniline; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C34H56N2O3
MOLECULAR WEIGHT: 540.82004
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)O.CNC1=CC=CC=C1.CN(C)C1=CC=CC=C1.C=O
Structure:
CAS RN: 83512-61-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H32O9
MOLECULAR WEIGHT: 500.53758
SMILES: C/C=C(\C)/[C@@H]1[C@@]2([C@H]3C=C[C@H]4C[C@H](CC[C@@H]4[C@]3(C(O1)(O2)[C@]5(C(=O)C(=C)OC5=O)OC(=O)C)C)C(=O)O)C
Structure:
CAS RN: 82987-09-5
CAS Name: 2-[[(E)-2-[[[1-[[1-[3-amino-2-[[2-amino-5-(diaminomethylideneamino)-3-methyl-1-oxopentyl]amino]-1-oxobutyl]-2-piperidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxobut-2-enyl]amino]-3-hydroxypropanoic acid
OPENEYE Name: 2-[[(E)-2-[[1-[1-[3-amino-2-[(2-amino-5-guanidino-3-methyl-pentanoyl)amino]butanoyl]piperidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]but-2-enoyl]amino]-3-hydroxy-propanoic acid
IUPAC Name: 2-[[(E)-2-[[1-[1-[3-amino-2-[[2-amino-5-(diaminomethylideneamino)-3-methylpentanoyl]amino]butanoyl]piperidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]but-2-enoyl]amino]-3-hydroxypropanoic acid
SYSTEMATIC NAME: 2-[[(E)-2-[[1-[1-[3-azanyl-2-[[2-azanyl-5-[bis(azanyl)methylideneamino]-3-methyl-pentanoyl]amino]butanoyl]piperidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]but-2-enoyl]amino]-3-oxidanyl-propanoic acid
MOLECULAR FORMULA: C29H50N10O8
MOLECULAR WEIGHT: 666.7695
SMILES: C/C=C(\C(=O)NC(CO)C(=O)O)/NC(=O)C1CCCN1C(=O)C2CCCCN2C(=O)C(C(C)N)NC(=O)C(C(C)CCN=C(N)N)N
Structure:
CAS RN: 82933-91-3
CAS Name: (E)-9-octadecenoic acid [(2R,3S,4S,5R)-3,4-dihydroxy-6-methoxy-5-[(E)-1-oxooctadec-9-enoxy]-2-oxanyl]methyl ester
OPENEYE Name: [(2R,3S,4S,5R)-3,4-dihydroxy-6-methoxy-5-[(E)-octadec-9-enoyl]oxy-tetrahydropyran-2-yl]methyl (E)-octadec-9-enoate
IUPAC Name: [(2R,3S,4S,5R)-3,4-dihydroxy-6-methoxy-5-[(E)-octadec-9-enoyl]oxyoxan-2-yl]methyl (E)-octadec-9-enoate
SYSTEMATIC NAME: [(2R,3S,4S,5R)-6-methoxy-5-[(E)-octadec-9-enoyl]oxy-3,4-bis(oxidanyl)oxan-2-yl]methyl (E)-octadec-9-enoate
MOLECULAR FORMULA: C43H78O8
MOLECULAR WEIGHT: 723.07462
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OC)OC(=O)CCCCCCC/C=C/CCCCCCCC)O)O
Structure:
CAS RN: 82784-84-7
CAS Name: (E)-2,5,6-trimethyl-4-heptenal
OPENEYE Name: (E)-2,5,6-trimethylhept-4-enal
IUPAC Name: (E)-2,5,6-trimethylhept-4-enal
SYSTEMATIC NAME: (E)-2,5,6-trimethylhept-4-enal
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(C)/C(=C/CC(C)C=O)/C
Structure:
CAS RN: 81782-77-6
CAS Name: (E)-4-methyl-3-decen-5-ol
OPENEYE Name: (E)-4-methyldec-3-en-5-ol
IUPAC Name: (E)-4-methyldec-3-en-5-ol
SYSTEMATIC NAME: (E)-4-methyldec-3-en-5-ol
MOLECULAR FORMULA: C11H22O
MOLECULAR WEIGHT: 170.29178
SMILES: CCCCCC(/C(=C/CC)/C)O
Structure:
CAS RN: 18445-71-1
CAS Name: (E)-4-hydroxy-2-butenal
OPENEYE Name: (E)-4-hydroxybut-2-enal
IUPAC Name: (E)-4-hydroxybut-2-enal
SYSTEMATIC NAME: (E)-4-oxidanylbut-2-enal
MOLECULAR FORMULA: C4H6O2
MOLECULAR WEIGHT: 86.08924
SMILES: C(/C=C/C=O)O
Structure:
CAS RN: 80614-21-7
CAS Name: 3-pyridinecarboxylic acid [(E)-1-(1-imidazolyl)oct-1-en-3-yl] ester
OPENEYE Name: 1-[(E)-2-imidazol-1-ylvinyl]hexyl pyridine-3-carboxylate
IUPAC Name: [(E)-1-imidazol-1-yloct-1-en-3-yl] pyridine-3-carboxylate
SYSTEMATIC NAME: [(E)-1-imidazol-1-yloct-1-en-3-yl] pyridine-3-carboxylate
MOLECULAR FORMULA: C17H21N3O2
MOLECULAR WEIGHT: 299.36754
SMILES: CCCCCC(/C=C/N1C=CN=C1)OC(=O)C2=CN=CC=C2
Structure:
CAS RN: 191349-60-7
CAS Name: (E)-2-butenedioic acid; N-[4-[(1S)-4-[ethyl-(6-fluoro-6-methylheptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide
OPENEYE Name: N-[4-[(1S)-4-[ethyl-(6-fluoro-6-methyl-heptyl)amino]-1-hydroxy-butyl]phenyl]methanesulfonamide; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; N-[4-[(1S)-4-[ethyl-(6-fluoro-6-methylheptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide
SYSTEMATIC NAME: (E)-but-2-enedioic acid; N-[4-[(1S)-4-[ethyl-(6-fluoranyl-6-methyl-heptyl)amino]-1-oxidanyl-butyl]phenyl]methanesulfonamide
MOLECULAR FORMULA: C46H78F2N4O10S2
MOLECULAR WEIGHT: 949.259126
SMILES: CCN(CCCCCC(C)(C)F)CCC[C@@H](C1=CC=C(C=C1)NS(=O)(=O)C)O.CCN(CCCCCC(C)(C)F)CCC[C@@H](C1=CC=C(C=C1)NS(=O)(=O)C)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 68815-53-2
CAS Name: 2-butanone; (2E)-3,7-dimethylocta-2,6-dienal; methanol
OPENEYE Name: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
IUPAC Name: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
SYSTEMATIC NAME: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
MOLECULAR FORMULA: C15H28O3
MOLECULAR WEIGHT: 256.38102
SMILES: CCC(=O)C.CC(=CCC/C(=C/C=O)/C)C.CO
Structure:
CAS RN: 68937-18-8
CAS Name: 2-butanone; (2E)-3,7-dimethylocta-2,6-dienal; methanol
OPENEYE Name: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
IUPAC Name: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
SYSTEMATIC NAME: butan-2-one; (2E)-3,7-dimethylocta-2,6-dienal; methanol
MOLECULAR FORMULA: C15H28O3
MOLECULAR WEIGHT: 256.38102
SMILES: CCC(=O)C.CC(=CCC/C(=C/C=O)/C)C.CO
Structure:
CAS RN: 68815-52-1
CAS Name: (2E)-3,7-dimethylocta-2,6-dienal; 2-propanone
OPENEYE Name: acetone; (2E)-3,7-dimethylocta-2,6-dienal
IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one
SYSTEMATIC NAME: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one
MOLECULAR FORMULA: C13H22O2
MOLECULAR WEIGHT: 210.31258
SMILES: CC(=CCC/C(=C/C=O)/C)C.CC(=O)C
Structure:
CAS RN: 68937-52-0
CAS Name: (2E)-3,7-dimethylocta-2,6-dienal; 2-propanone
OPENEYE Name: acetone; (2E)-3,7-dimethylocta-2,6-dienal
IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one
SYSTEMATIC NAME: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one
MOLECULAR FORMULA: C13H22O2
MOLECULAR WEIGHT: 210.31258
SMILES: CC(=CCC/C(=C/C=O)/C)C.CC(=O)C
Structure:
CAS RN: 108614-89-7
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 66085-55-0
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 68540-48-7
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 69068-47-9
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 69929-32-4
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 70068-66-5
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; (9Z,12Z)-octadeca-9,12-dienoic acid
MOLECULAR FORMULA: C42H82N4O4
MOLECULAR WEIGHT: 707.12488
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN
Structure:
CAS RN: 68515-72-0
CAS Name: 1-amino-2-propanol; 3-[(Z)-dodec-1-enyl]oxolane-2,5-dione
OPENEYE Name: 1-aminopropan-2-ol; 3-[(Z)-dodec-1-enyl]tetrahydrofuran-2,5-dione
IUPAC Name: 1-aminopropan-2-ol; 3-[(Z)-dodec-1-enyl]oxolane-2,5-dione
SYSTEMATIC NAME: 1-azanylpropan-2-ol; 3-[(Z)-dodec-1-enyl]oxolane-2,5-dione
MOLECULAR FORMULA: C19H35NO4
MOLECULAR WEIGHT: 341.4855
SMILES: CCCCCCCCCC/C=C\C1CC(=O)OC1=O.CC(CN)O
Structure:
CAS RN: 68478-81-9
CAS Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; (Z)-9-octadecenoic acid
OPENEYE Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 3-[(E)-dodec-1-enyl]tetrahydrofuran-2,5-dione; (Z)-octadec-9-enoic acid
IUPAC Name: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: N'-[2-(2-azanylethylamino)ethyl]ethane-1,2-diamine; 3-[(E)-dodec-1-enyl]oxolane-2,5-dione; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C40H78N4O5
MOLECULAR WEIGHT: 695.07112
SMILES: CCCCCCCCCC/C=C/C1CC(=O)OC1=O.CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CNCCNCCN)N
Structure:
CAS RN: 68140-41-0
CAS Name: 2-amino-2-methyl-1-propanol; (Z)-9-octadecenoic acid
OPENEYE Name: 2-amino-2-methyl-propan-1-ol; (Z)-octadec-9-enoic acid
IUPAC Name: 2-amino-2-methylpropan-1-ol; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: 2-azanyl-2-methyl-propan-1-ol; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C22H45NO3
MOLECULAR WEIGHT: 371.5976
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)O.CC(C)(CO)N
Structure:
CAS RN: 68478-78-4
CAS Name: 2-amino-2-methyl-1-propanol; (Z)-9-octadecenoic acid
OPENEYE Name: 2-amino-2-methyl-propan-1-ol; (Z)-octadec-9-enoic acid
IUPAC Name: 2-amino-2-methylpropan-1-ol; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: 2-azanyl-2-methyl-propan-1-ol; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C22H45NO3
MOLECULAR WEIGHT: 371.5976
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)O.CC(C)(CO)N
Structure:
CAS RN: 68057-99-8
CAS Name: potassium sodium 5-(4-phenyl-2-triazolyl)-2-[(E)-2-[4-(4-phenyl-2-triazolyl)-2-sulfonatophenyl]ethenyl]benzenesulfonate
OPENEYE Name: potassium sodium 5-(4-phenyltriazol-2-yl)-2-[(E)-2-[4-(4-phenyltriazol-2-yl)-2-sulfonato-phenyl]vinyl]benzenesulfonate
IUPAC Name: potassium sodium 5-(4-phenyltriazol-2-yl)-2-[(E)-2-[4-(4-phenyltriazol-2-yl)-2-sulfonatophenyl]ethenyl]benzenesulfonate
SYSTEMATIC NAME: potassium sodium 5-(4-phenyl-1,2,3-triazol-2-yl)-2-[(E)-2-[4-(4-phenyl-1,2,3-triazol-2-yl)-2-sulfonato-phenyl]ethenyl]benzenesulfonate
MOLECULAR FORMULA: C30H20KN6NaO6S2
MOLECULAR WEIGHT: 686.73447
SMILES: C1=CC=C(C=C1)C2=NN(N=C2)C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N5N=CC(=N5)C6=CC=CC=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]
Structure:
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