Catalog Number:
AG002I0V
Chemical Name:
Tegaserod maleate
CAS Number:
189188-57-6
Molecular Formula:
C20H27N5O5
Molecular Weight:
417.4589
MDL Number:
MFCD04116201
IUPAC Name:
(Z)-but-2-enedioic acid;1-[(E)-(5-methoxy-1H-indol-3-yl)methylideneamino]-2-pentylguanidine
InChI:
InChI=1S/C16H23N5O.C4H4O4/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15;5-3(6)1-2-4(7)8/h6-7,9-11,19H,3-5,8H2,1-2H3,(H3,17,18,21);1-2H,(H,5,6)(H,7,8)/b20-11+;2-1-
InChI Key:
CPDDZSSEAVLMRY-FEQFWAPWSA-N
SMILES:
OC(=O)/C=C\C(=O)O.CCCCCNC(=N)NN=Cc1c[nH]c2c1cc(OC)cc2
UNII:
E5XNT3RF5A
NSC Number:
760425
