CAS RN: 139226-28-1
CAS Name: (5Z)-2-amino-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4-thiazolone
OPENEYE Name: (5Z)-2-amino-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]thiazol-4-one
IUPAC Name: (5Z)-2-amino-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
SYSTEMATIC NAME: (5Z)-2-azanyl-5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one
MOLECULAR FORMULA: C18H24N2O2S
MOLECULAR WEIGHT: 332.46036
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C\2/C(=O)N=C(S2)N
Structure:
CAS RN: 62541-85-9
CAS Name: (3E)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-N,N-dimethyl-1-propanamine
OPENEYE Name: (3E)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-N,N-dimethyl-propan-1-amine
IUPAC Name: (3E)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: (3E)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C18H22N2
MOLECULAR WEIGHT: 266.38068
SMILES: CN(C)CC/C=C/1\C2=CC=CC=C2CCN3C1=CC=C3
Structure:
CAS RN: 18907-69-2
CAS Name: 1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethanone hydrochloride
OPENEYE Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]ethanone hydrochloride
IUPAC Name: 1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone hydrochloride
SYSTEMATIC NAME: 1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone hydrochloride
MOLECULAR FORMULA: C15H21ClN2O
MOLECULAR WEIGHT: 280.79304
SMILES: CC(=O)N1CCN(CC1)C/C=C/C2=CC=CC=C2.Cl
Structure:
CAS RN: 18900-05-5
CAS Name: 1-[4-(1-azepanyl)but-2-ynyl]-2-pyrrolidinone; (E)-2-butenedioic acid
OPENEYE Name: 1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one; fumaric acid
IUPAC Name: 1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one; (E)-but-2-enedioic acid
SYSTEMATIC NAME: 1-[4-(azepan-1-yl)but-2-ynyl]pyrrolidin-2-one; (E)-but-2-enedioic acid
MOLECULAR FORMULA: C40H56N4O14
MOLECULAR WEIGHT: 816.89104
SMILES: C1CCN(CCC1)CC#CCN2C(=O)CCC2.C1CCN(CCC1)CC#CCN2C(=O)CCC2.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 18886-42-5
CAS Name: (E)-2-butenedioic acid; propanoic acid [1-(1-methyl-3-pyrrolidinyl)-1-phenylpropyl] ester
OPENEYE Name: fumaric acid; [1-(1-methylpyrrolidin-3-yl)-1-phenyl-propyl] propanoate
IUPAC Name: (E)-but-2-enedioic acid; [1-(1-methylpyrrolidin-3-yl)-1-phenylpropyl] propanoate
SYSTEMATIC NAME: (E)-but-2-enedioic acid; [1-(1-methylpyrrolidin-3-yl)-1-phenyl-propyl] propanoate
MOLECULAR FORMULA: C21H29NO6
MOLECULAR WEIGHT: 391.45806
SMILES: CCC(=O)OC(CC)(C1CCN(C1)C)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 18860-95-2
CAS Name: (E)-1,4-dibromo-2-methyl-2-butene
OPENEYE Name: (E)-1,4-dibromo-2-methyl-but-2-ene
IUPAC Name: (E)-1,4-dibromo-2-methylbut-2-ene
SYSTEMATIC NAME: (E)-1,4-bis(bromanyl)-2-methyl-but-2-ene
MOLECULAR FORMULA: C5H8Br2
MOLECULAR WEIGHT: 227.92502
SMILES: C/C(=C\CBr)/CBr
Structure:
CAS RN: 18763-66-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H40N4O9
MOLECULAR WEIGHT: 636.6921
SMILES: C1C2N(C(C1)C(CC2)OC3C4=CC=CC=C4CCC5=CC=CC=C35)CCN=C(N)N.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 18520-38-2
CAS Name: N-(1-butyl-6-quinolin-1-iumyl)-4-[(E)-3-[(1-butyl-6-quinolin-1-iumyl)amino]-3-oxoprop-1-enyl]benzamide; 4-methylbenzenesulfonate
OPENEYE Name: N-(1-butylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-butylquinolin-1-ium-6-yl)amino]-3-oxo-prop-1-enyl]benzamide; 4-methylbenzenesulfonate
IUPAC Name: N-(1-butylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-butylquinolin-1-ium-6-yl)amino]-3-oxoprop-1-enyl]benzamide; 4-methylbenzenesulfonate
SYSTEMATIC NAME: N-(1-butylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-butylquinolin-1-ium-6-yl)amino]-3-oxidanylidene-prop-1-enyl]benzamide; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C50H52N4O8S2
MOLECULAR WEIGHT: 901.09988
SMILES: CCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
Structure:
CAS RN: 18520-36-0
CAS Name: N-(1-ethyl-6-quinolin-1-iumyl)-4-[(E)-3-[(1-ethyl-6-quinolin-1-iumyl)amino]-3-oxoprop-1-enyl]benzamide; 4-methylbenzenesulfonate
OPENEYE Name: N-(1-ethylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-ethylquinolin-1-ium-6-yl)amino]-3-oxo-prop-1-enyl]benzamide; 4-methylbenzenesulfonate
IUPAC Name: N-(1-ethylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-ethylquinolin-1-ium-6-yl)amino]-3-oxoprop-1-enyl]benzamide; 4-methylbenzenesulfonate
SYSTEMATIC NAME: N-(1-ethylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-ethylquinolin-1-ium-6-yl)amino]-3-oxidanylidene-prop-1-enyl]benzamide; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C46H44N4O8S2
MOLECULAR WEIGHT: 844.99356
SMILES: CC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
Structure:
CAS RN: 18520-35-9
CAS Name: 4-methylbenzenesulfonate; N-(1-methyl-6-quinolin-1-iumyl)-4-[(E)-3-[(1-methyl-6-quinolin-1-iumyl)amino]-3-oxoprop-1-enyl]benzamide
OPENEYE Name: 4-methylbenzenesulfonate; N-(1-methylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-methylquinolin-1-ium-6-yl)amino]-3-oxo-prop-1-enyl]benzamide
IUPAC Name: 4-methylbenzenesulfonate; N-(1-methylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-methylquinolin-1-ium-6-yl)amino]-3-oxoprop-1-enyl]benzamide
SYSTEMATIC NAME: 4-methylbenzenesulfonate; N-(1-methylquinolin-1-ium-6-yl)-4-[(E)-3-[(1-methylquinolin-1-ium-6-yl)amino]-3-oxidanylidene-prop-1-enyl]benzamide
MOLECULAR FORMULA: C44H40N4O8S2
MOLECULAR WEIGHT: 816.9404
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)C
Structure:
CAS RN: 18361-50-7
CAS Name: acetic acid [(11Z,13E)-6-[[5-[(5-acetyloxy-4-hydroxy-4,6-dimethyl-2-oxanyl)oxy]-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] ester
OPENEYE Name: [(11Z,13E)-6-[5-(5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] acetate
IUPAC Name: [(11Z,13E)-6-[5-(5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] acetate
SYSTEMATIC NAME: [(11Z,13E)-6-[5-(5-acetyloxy-4,6-dimethyl-4-oxidanyl-oxan-2-yl)oxy-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-5-methoxy-9,16-dimethyl-10-oxidanyl-2-oxidanylidene-7-(2-oxidanylideneethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] ethanoate
MOLECULAR FORMULA: C39H63NO15
MOLECULAR WEIGHT: 785.91522
SMILES: CC1C/C=C/C=C\C(C(CC(C(C(C(CC(=O)O1)OC(=O)C)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)O
Structure:
CAS RN: 18361-49-4
CAS Name: acetic acid [6-[[6-[[(11Z,13E)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyl-3-oxanyl]oxy]-4-hydroxy-2,4-dimethyl-3-oxanyl] ester
OPENEYE Name: [6-[6-[[(11Z,13E)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyl-tetrahydropyran-3-yl]oxy-4-hydroxy-2,4-dimethyl-tetrahydropyran-3-yl] acetate
IUPAC Name: [6-[6-[[(11Z,13E)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] acetate
SYSTEMATIC NAME: [6-[4-(dimethylamino)-6-[[(11Z,13E)-5-methoxy-9,16-dimethyl-4,10-bis(oxidanyl)-2-oxidanylidene-7-(2-oxidanylideneethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-2-methyl-5-oxidanyl-oxan-3-yl]oxy-2,4-dimethyl-4-oxidanyl-oxan-3-yl] ethanoate
MOLECULAR FORMULA: C37H61NO14
MOLECULAR WEIGHT: 743.87854
SMILES: CC1C/C=C/C=C\C(C(CC(C(C(C(CC(=O)O1)O)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)O
Structure:
CAS RN: 18361-46-1
CAS Name: butanoic acid [6-[[6-[[(11Z,13E)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyl-3-oxanyl]oxy]-4-hydroxy-2,4-dimethyl-3-oxanyl] ester
OPENEYE Name: [6-[6-[[(11Z,13E)-4-acetoxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyl-tetrahydropyran-3-yl]oxy-4-hydroxy-2,4-dimethyl-tetrahydropyran-3-yl] butanoate
IUPAC Name: [6-[6-[[(11Z,13E)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] butanoate
SYSTEMATIC NAME: [6-[6-[[(11Z,13E)-4-acetyloxy-5-methoxy-9,16-dimethyl-10-oxidanyl-2-oxidanylidene-7-(2-oxidanylideneethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-2-methyl-5-oxidanyl-oxan-3-yl]oxy-2,4-dimethyl-4-oxidanyl-oxan-3-yl] butanoate
MOLECULAR FORMULA: C41H67NO15
MOLECULAR WEIGHT: 813.96838
SMILES: CCCC(=O)OC1C(OC(CC1(C)O)OC2C(OC(C(C2N(C)C)O)OC3C(CC(C(/C=C\C=C\CC(OC(=O)CC(C3OC)OC(=O)C)C)O)C)CC=O)C)C
Structure:
CAS RN: 18288-84-1
CAS Name: (Z)-2-butenedioic acid; 11-[(1-methyl-3-piperidinyl)methyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: maleic acid; 11-[(1-methyl-3-piperidyl)methyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
IUPAC Name: (Z)-but-2-enedioic acid; 11-[(1-methylpiperidin-3-yl)methyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-[(1-methylpiperidin-3-yl)methyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C30H36N2O8
MOLECULAR WEIGHT: 552.61544
SMILES: CN1CC(CCC1)CN2CC3=CC=CC=C3CC4=CC=CC=C4C2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18285-58-0
CAS Name: (Z)-2-butenedioic acid; 11-propan-2-yl-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: 11-isopropyl-10,12-dihydro-5H-benzo[d][2]benzazocine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 11-propan-2-yl-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-propan-2-yl-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C22H25NO4
MOLECULAR WEIGHT: 367.4382
SMILES: CC(C)N1CC2=CC=CC=C2CC3=CC=CC=C3C1.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18221-53-9
CAS Name: 4-hexyl-2-[(E)-2-(2-hydroxyphenyl)ethenyl]phenol
OPENEYE Name: 4-hexyl-2-[(E)-2-(2-hydroxyphenyl)vinyl]phenol
IUPAC Name: 4-hexyl-2-[(E)-2-(2-hydroxyphenyl)ethenyl]phenol
SYSTEMATIC NAME: 4-hexyl-2-[(E)-2-(2-hydroxyphenyl)ethenyl]phenol
MOLECULAR FORMULA: C20H24O2
MOLECULAR WEIGHT: 296.40336
SMILES: CCCCCCC1=CC(=C(C=C1)O)/C=C/C2=CC=CC=C2O
Structure:
CAS RN: 18198-06-6
CAS Name: 11-[(2E)-3,7-dimethylocta-2,6-dienyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: 11-[(2E)-3,7-dimethylocta-2,6-dienyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
IUPAC Name: 11-[(2E)-3,7-dimethylocta-2,6-dienyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: 11-[(2E)-3,7-dimethylocta-2,6-dienyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C25H31N
MOLECULAR WEIGHT: 345.52034
SMILES: CC(=CCC/C(=C/CN1CC2=CC=CC=C2CC3=CC=CC=C3C1)/C)C
Structure:
CAS RN: 18181-01-6
CAS Name: (Z)-2-butenedioic acid; 11-ethyl-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: 11-ethyl-10,12-dihydro-5H-benzo[d][2]benzazocine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 11-ethyl-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-ethyl-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C21H23NO4
MOLECULAR WEIGHT: 353.41162
SMILES: CCN1CC2=CC=CC=C2CC3=CC=CC=C3C1.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18181-00-5
CAS Name: (Z)-2-butenedioic acid; 11-methyl-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: maleic acid; 11-methyl-10,12-dihydro-5H-benzo[d][2]benzazocine
IUPAC Name: (Z)-but-2-enedioic acid; 11-methyl-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-methyl-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CN1CC2=CC=CC=C2CC3=CC=CC=C3C1.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18180-92-2
CAS Name: (Z)-2-butenedioic acid; 11-[2-(1-pyrrolidinyl)ethyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: maleic acid; 11-(2-pyrrolidin-1-ylethyl)-10,12-dihydro-5H-benzo[d][2]benzazocine
IUPAC Name: (Z)-but-2-enedioic acid; 11-(2-pyrrolidin-1-ylethyl)-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-(2-pyrrolidin-1-ylethyl)-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C25H30N2O4
MOLECULAR WEIGHT: 422.5167
SMILES: C1CCN(C1)CCN2CC3=CC=CC=C3CC4=CC=CC=C4C2.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18180-91-1
CAS Name: (Z)-2-butenedioic acid; 2-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-N,N-diethylethanamine
OPENEYE Name: 2-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-N,N-diethyl-ethanamine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 2-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-N,N-diethylethanamine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 2-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-N,N-diethyl-ethanamine
MOLECULAR FORMULA: C29H36N2O8
MOLECULAR WEIGHT: 540.60474
SMILES: CCN(CCN1CC2=CC=CC=C2CC3=CC=CC=C3C1)CC.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18180-90-0
CAS Name: (Z)-2-butenedioic acid; 11-[2-(1-methyl-2-piperidinyl)ethyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
OPENEYE Name: maleic acid; 11-[2-(1-methyl-2-piperidyl)ethyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
IUPAC Name: (Z)-but-2-enedioic acid; 11-[2-(1-methylpiperidin-2-yl)ethyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 11-[2-(1-methylpiperidin-2-yl)ethyl]-10,12-dihydro-5H-benzo[d][2]benzazocine
MOLECULAR FORMULA: C31H38N2O8
MOLECULAR WEIGHT: 566.64202
SMILES: CN1C(CCCC1)CCN2CC3=CC=CC=C3CC4=CC=CC=C4C2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 18180-89-7
CAS Name: (Z)-2-butenedioic acid; 1-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)-2-propanol
OPENEYE Name: 1-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)propan-2-ol; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)propan-2-ol
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(10,12-dihydro-5H-benzo[d][2]benzazocin-11-yl)propan-2-ol
MOLECULAR FORMULA: C22H25NO5
MOLECULAR WEIGHT: 383.4376
SMILES: CC(CN1CC2=CC=CC=C2CC3=CC=CC=C3C1)O.C(=C\C(=O)O)\C(=O)O
Structure:
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