| SpectraBase Spectrum ID |
5cc4mGLUTWm |
| Name |
7,16-Bis{4-[1-(3,5-dimethoxycarbonyl)phenyl]-4,5-dihydro-1H-pyrazol-3-yl phenyl}-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C50H58N6O12 |
| InChI |
InChI=1S/C50H58N6O12/c1-61-47(57)37-28-38(48(58)62-2)32-43(31-37)55-14-12-45(51-55)35-8-10-41(11-9-35)53-16-20-65-24-26-67-22-18-54(19-23-68-27-25-66-21-17-53)42-7-5-6-36(30-42)46-13-15-56(52-46)44-33-39(49(59)63-3)29-40(34-44)50(60)64-4/h5-11,28-34H,12-27H2,1-4H3 |
| InChIKey |
YPECMIZXFVQZNO-UHFFFAOYSA-N |
| Molecular Weight |
935.044 g/mol |
| SMILES |
c1(N2N=C(CC2)c2cc(N3CCOCCOCCN(CCOCCOCC3)c3ccc(C4=NN(c5cc(C(=O)OC)cc(c5)C(=O)OC)CC4)cc3)ccc2)cc(C(=O)OC)cc(c1)C(=O)OC |
| SPLASH |
splash10-001r-0000100009-3c7ac1b76f9c54905346 |
| Source of Spectrum |
F-55-5225-27 |
| Synonyms |
1,3-Dimethyl 5-(3-{4-[16-(3-{1-[3,5-bis(methoxycarbonyl)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}phenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecan-7-yl]phenyl}-4,5-dihydro-1H-pyrazol-1-yl)benzene-1,3-dicarboxylate |
| Wiley ID |
837833 |
![7,16-Bis{4-[1-(3,5-dimethoxycarbonyl)phenyl]-4,5-dihydro-1H-pyrazol-3-yl phenyl}-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane](/api/spectrum/5cc4mGLUTWm/structure.png?h=300&w=458 "7,16-Bis{4-[1-(3,5-dimethoxycarbonyl)phenyl]-4,5-dihydro-1H-pyrazol-3-yl phenyl}-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane")
