2-[[1-cyclohexyl-2-(furan-3-yl)-4-methyl-benzimidazol-5-yl]carbonylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[1-cyclohexyl-2-(furan-3-yl)-4-methyl-benzimidazol-5-yl]carbonylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[1-cyclohexyl-2-(3-furyl)-4-methyl-benzimidazole-5-carbonyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[[[1-cyclohexyl-2-(3-furanyl)-4-methyl-5-benzimidazolyl]-oxomethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[1-cyclohexyl-2-(furan-3-yl)-4-methylbenzimidazole-5-carbonyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 2-[[1-cyclohexyl-2-(3-furyl)-4-methyl-benzimidazole-5-carbonyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propionic acid Formula: C30H30N4O5 MolecularWeight: 526.583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(N2C3CCCCC3)C4=COC=C4)C(=O)NC(CC5=CNC6=C5C=C(C=C6)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1N=C(N2C3CCCCC3)C4=COC=C4)C(=O)NC(CC5=CNC6=C5C=C(C=C6)O)C(=O)O

InChI

InChI=1S/C30H30N4O5/c1-17-22(29(36)32-25(30(37)38)13-19-15-31-24-9-7-21(35)14-23(19)24)8-10-26-27(17)33-28(18-11-12-39-16-18)34(26)20-5-3-2-4-6-20/h7-12,14-16,20,25,31,35H,2-6,13H2,1H3,(H,32,36)(H,37,38)