naphthalen-1-ylmethyl 3-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: naphthalen-1-ylmethyl 3-[[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: 1-naphthylmethyl 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 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-[[2-(4-carbamimidoylphenyl)-1-methylbenzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-1-methyl-benzimidazole-5-carbonyl]amino]propionic acid 1-naphthylmethyl ester Formula: C30H27N5O3 MolecularWeight: 505.56708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OCC3=CC=CC4=CC=CC=C43)N=C1C5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OCC3=CC=CC4=CC=CC=C43)N=C1C5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C30H27N5O3/c1-35-26-14-13-22(17-25(26)34-29(35)21-11-9-20(10-12-21)28(31)32)30(37)33-16-15-27(36)38-18-23-7-4-6-19-5-2-3-8-24(19)23/h2-14,17H,15-16,18H2,1H3,(H3,31,32)(H,33,37)