2,3-dihydro-1H-inden-2-yl 3-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: 2,3-dihydro-1H-inden-2-yl 3-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: indan-2-yl 3-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-carbamimidoylphenyl)-1-methyl-5-benzimidazolyl]-oxomethyl]amino]propanoic acid 2,3-dihydro-1H-inden-2-yl ester IUPAC Name: 2,3-dihydro-1H-inden-2-yl 3-[[2-(4-carbamimidoylphenyl)-1-methylbenzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-1-methyl-benzimidazole-5-carbonyl]amino]propionic acid indan-2-yl ester Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OC3CC4=CC=CC=C4C3)N=C1C5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OC3CC4=CC=CC=C4C3)N=C1C5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C28H27N5O3/c1-33-24-11-10-21(16-23(24)32-27(33)18-8-6-17(7-9-18)26(29)30)28(35)31-13-12-25(34)36-22-14-19-4-2-3-5-20(19)15-22/h2-11,16,22H,12-15H2,1H3,(H3,29,30)(H,31,35)