82924-03-6
PENTOPRIL
Name
PENTOPRIL
Formula
C18 H23 N O5
MolWeight
333.382
1Identification
【Name】
PENTOPRIL
【CAS】
【MDL】
MFCD00865782
【English Synonyms】
【Formula】
C18 H23 N O5
【MolWeight】
333.382
【Inchi】
InChI=1S/C18H23NO5/c1-4-24-18(23)12(3)9-11(2)16(20)19-14-8-6-5-7-13(14)10-15(19)17(21)22/h5-8,11-12,15H,4,9-10H2,1-3H3,(H,21,22)/t11-,12-,15+/m1/s1
【InChIKey】
InChIKey=NVXFXLSOGLFXKQ-JMSVASOKSA-N
【SMILES】
CCOC(=O)[C@H](C)C[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PENTOPRIL.cml
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