methyl 3-[[2-(4-carbamimidoylphenyl)-1-(3-methoxy-3-oxidanylidene-propyl)benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(3-methoxy-3-oxidanylidene-propyl)benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(3-methoxy-3-oxo-propyl)benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-carbamimidoylphenyl)-1-(3-methoxy-3-oxopropyl)-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamimidoylphenyl)-1-(3-methoxy-3-oxopropyl)benzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-1-(3-keto-3-methoxy-propyl)benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C23H25N5O5 MolecularWeight: 451.4751

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=N)N)CCC(=O)OC

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=N)N)CCC(=O)OC

InChI

InChI=1S/C23H25N5O5/c1-32-19(29)9-11-26-23(31)16-7-8-18-17(13-16)27-22(28(18)12-10-20(30)33-2)15-5-3-14(4-6-15)21(24)25/h3-8,13H,9-12H2,1-2H3,(H3,24,25)(H,26,31)