acetyloxymethyl 3-[4-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]phenyl]propanoate

Systemtic Name: acetyloxymethyl 3-[4-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]phenyl]propanoate Openeye Name: acetoxymethyl 3-[4-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]phenyl]propanoate CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-1-methyl-2-imidazolyl]phenyl]propanoic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 3-[4-[4-(4-carbamimidoylphenyl)-1-methylimidazol-2-yl]phenyl]propanoate Traditional Name: 3-[4-[4-(4-amidinophenyl)-1-methyl-imidazol-2-yl]phenyl]propionic acid acetoxymethyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)CCC1=CC=C(C=C1)C2=NC(=CN2C)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(=O)OCOC(=O)CCC1=CC=C(C=C1)C2=NC(=CN2C)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H24N4O4/c1-15(28)30-14-31-21(29)12-5-16-3-6-19(7-4-16)23-26-20(13-27(23)2)17-8-10-18(11-9-17)22(24)25/h3-4,6-11,13H,5,12,14H2,1-2H3,(H3,24,25)