ethyl 3-[[2-(chloromethyl)-1-methyl-benzimidazol-5-yl]oxycarbonyl-propyl-amino]propanoate

Systemtic Name: ethyl 3-[[2-(chloromethyl)-1-methyl-benzimidazol-5-yl]oxycarbonyl-propyl-amino]propanoate Openeye Name: ethyl 3-[[2-(chloromethyl)-1-methyl-benzimidazol-5-yl]oxycarbonyl-propyl-amino]propanoate CAS Name: 3-[[[2-(chloromethyl)-1-methyl-5-benzimidazolyl]oxy-oxomethyl]-propylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(chloromethyl)-1-methylbenzimidazol-5-yl]oxycarbonyl-propylamino]propanoate Traditional Name: 3-[[2-(chloromethyl)-1-methyl-benzimidazol-5-yl]oxycarbonyl-propyl-amino]propionic acid ethyl ester Formula: C18H24ClN3O4 MolecularWeight: 381.85386

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)OCC)C(=O)OC1=CC2=C(C=C1)N(C(=N2)CCl)C

Isomeric SMILES

CCCN(CCC(=O)OCC)C(=O)OC1=CC2=C(C=C1)N(C(=N2)CCl)C

InChI

InChI=1S/C18H24ClN3O4/c1-4-9-22(10-8-17(23)25-5-2)18(24)26-13-6-7-15-14(11-13)20-16(12-19)21(15)3/h6-7,11H,4-5,8-10,12H2,1-3H3