dimethyl 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylate Openeye Name: dimethyl 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylate CAS Name: 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylate Traditional Name: 1-[3-(4-aminophenyl)propyl]imidazole-4,5-dicarboxylic acid dimethyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C=N1)CCCC2=CC=C(C=C2)N)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(C=N1)CCCC2=CC=C(C=C2)N)C(=O)OC

InChI

InChI=1S/C16H19N3O4/c1-22-15(20)13-14(16(21)23-2)19(10-18-13)9-3-4-11-5-7-12(17)8-6-11/h5-8,10H,3-4,9,17H2,1-2H3