2-[[2-[(6-aminocarbonyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazol-5-yl]carbonylamino]-5-phosphono-pentanoic acid

Systemtic Name: 2-[[2-[(6-aminocarbonyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazol-5-yl]carbonylamino]-5-phosphono-pentanoic acid Openeye Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazole-5-carbonyl]amino]-5-phosphono-pentanoic acid CAS Name: 2-[[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-5-benzimidazolyl]-oxomethyl]amino]-5-phosphonopentanoic acid IUPAC Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methylbenzimidazole-5-carbonyl]amino]-5-phosphonopentanoic acid Traditional Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazole-5-carbonyl]amino]-5-phosphono-valeric acid Formula: C23H25N6O7P MolecularWeight: 528.454361

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NC(CCCP(=O)(O)O)C(=O)O)N=C1CC3=NC4=C(N3)C=C(C=C4)C(=O)N

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NC(CCCP(=O)(O)O)C(=O)O)N=C1CC3=NC4=C(N3)C=C(C=C4)C(=O)N

InChI

InChI=1S/C23H25N6O7P/c1-29-18-10-13(22(31)28-16(23(32)33)3-2-8-37(34,35)36)5-7-15(18)27-20(29)11-19-25-14-6-4-12(21(24)30)9-17(14)26-19/h4-7,9-10,16H,2-3,8,11H2,1H3,(H2,24,30)(H,25,26)(H,28,31)(H,32,33)(H2,34,35,36)