CAS RN: 40536-37-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H41N3O12
MOLECULAR WEIGHT: 707.72364
SMILES: C1N(CCN(C1)CC(=O)N2CCOCC2)CC3OC4(OC3)C5=CC=CC=C5C=CC6=CC=CC=C46.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-36-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H41N3O11
MOLECULAR WEIGHT: 691.72424
SMILES: C1CN(CC1)C(=O)CN2CCN(CC2)CC3OC4(OC3)C5=CC=CC=C5C=CC6=CC=CC=C46.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-33-2
CAS Name:
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IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H39N3O11
MOLECULAR WEIGHT: 665.68696
SMILES: CN(C(=O)CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4C=CC5=CC=CC=C35)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-32-1
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OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C35H41N3O11
MOLECULAR WEIGHT: 679.71354
SMILES: CC(NC(=O)CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4C=CC5=CC=CC=C35)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-31-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H37N3O11
MOLECULAR WEIGHT: 651.66038
SMILES: CNC(=O)CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4C=CC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-30-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H38N2O12
MOLECULAR WEIGHT: 654.66102
SMILES: C1N(CCN(C1)CC(O)CO)CC2OC3(OC2)C4=CC=CC=C4C=CC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-29-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H34N2O10
MOLECULAR WEIGHT: 594.60906
SMILES: CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4C=CC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
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CAS RN: 40536-27-4
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IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H43N3O11
MOLECULAR WEIGHT: 693.74012
SMILES: C1CN(CC1)C(=O)CN2CCN(CC2)CC3OC4(OC3)C5=CC=CC=C5CCC6=CC=CC=C46.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-26-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H43N3O12
MOLECULAR WEIGHT: 709.73952
SMILES: C1C2=CC=CC=C2C3(OC(CO3)CN4CCN(CC4)CC(=O)N5CCOCC5)C6=CC=CC=C6C1.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-24-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H40N2O12
MOLECULAR WEIGHT: 668.6876
SMILES: CCOC(=O)CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4CCC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40536-23-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H36N2O10
MOLECULAR WEIGHT: 596.62494
SMILES: CN1CCN(CC1)CC2OC3(OC2)C4=CC=CC=C4CCC5=CC=CC=C35.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40411-10-7
CAS Name: (E)-2-butenedioic acid; (3Z)-3-(8-chloro-4-phenyl-3,4-dihydro-2H-1-benzoxepin-5-ylidene)-N,N-dimethyl-1-propanamine
OPENEYE Name: (3Z)-3-(8-chloro-4-phenyl-3,4-dihydro-2H-1-benzoxepin-5-ylidene)-N,N-dimethyl-propan-1-amine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; (3Z)-3-(8-chloro-4-phenyl-3,4-dihydro-2H-1-benzoxepin-5-ylidene)-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; (3Z)-3-(8-chloranyl-4-phenyl-3,4-dihydro-2H-1-benzoxepin-5-ylidene)-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C25H28ClNO5
MOLECULAR WEIGHT: 457.94652
SMILES: CN(C)CC/C=C\1/C(CCOC2=C1C=CC(=C2)Cl)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 40400-11-1
CAS Name: (E)-2-butenedioic acid; 1-methyl-4-[3-(methylseleno)-5-benzo[b][1]benzothiepinyl]piperazine
OPENEYE Name: fumaric acid; 1-methyl-4-(3-methylselanylbenzo[b][1]benzothiepin-5-yl)piperazine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-4-(3-methylselanylbenzo[b][1]benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-4-(3-methylselanylbenzo[b][1]benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C24H26N2O4SSe
MOLECULAR WEIGHT: 517.49924
SMILES: CN1CCN(CC1)C2=CC3=CC=CC=C3SC4=C2C=C(C=C4)[Se]C.C(=C/C(=O)O)\C(=O)O
Structure:
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