3-[3-[3-imidazol-1-ylpropyl(methyl)amino]propanoyloxy]butyl butanoate

Systemtic Name: 3-[3-[3-imidazol-1-ylpropyl(methyl)amino]propanoyloxy]butyl butanoate Openeye Name: 3-[3-[3-imidazol-1-ylpropyl(methyl)amino]propanoyloxy]butyl butanoate CAS Name: butanoic acid 3-[3-[3-(1-imidazolyl)propyl-methylamino]-1-oxopropoxy]butyl ester IUPAC Name: 3-[3-[3-imidazol-1-ylpropyl(methyl)amino]propanoyloxy]butyl butanoate Traditional Name: butyric acid 3-[3-[3-imidazol-1-ylpropyl(methyl)amino]propanoyloxy]butyl ester Formula: C18H31N3O4 MolecularWeight: 353.45644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCC(C)OC(=O)CCN(C)CCCN1C=CN=C1

Isomeric SMILES

CCCC(=O)OCCC(C)OC(=O)CCN(C)CCCN1C=CN=C1

InChI

InChI=1S/C18H31N3O4/c1-4-6-17(22)24-14-8-16(2)25-18(23)7-12-20(3)10-5-11-21-13-9-19-15-21/h9,13,15-16H,4-8,10-12,14H2,1-3H3