2-[[2-[(6-aminocarbonyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazol-5-yl]carbonylamino]-7-phosphono-heptanoic acid

Systemtic Name: 2-[[2-[(6-aminocarbonyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazol-5-yl]carbonylamino]-7-phosphono-heptanoic acid Openeye Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazole-5-carbonyl]amino]-7-phosphono-heptanoic acid CAS Name: 2-[[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-5-benzimidazolyl]-oxomethyl]amino]-7-phosphonoheptanoic acid IUPAC Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methylbenzimidazole-5-carbonyl]amino]-7-phosphonoheptanoic acid Traditional Name: 2-[[2-[(6-carbamoyl-1H-benzimidazol-2-yl)methyl]-3-methyl-benzimidazole-5-carbonyl]amino]-7-phosphono-enanthic acid Formula: C25H29N6O7P MolecularWeight: 556.507521

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H29N6O7P/c1-31-20-12-15(24(33)30-18(25(34)35)5-3-2-4-10-39(36,37)38)7-9-17(20)29-22(31)13-21-27-16-8-6-14(23(26)32)11-19(16)28-21/h6-9,11-12,18H,2-5,10,13H2,1H3,(H2,26,32)(H,27,28)(H,30,33)(H,34,35)(H2,36,37,38)