3-cyclohexyl-3-[[1-(4-methylphenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-(4-methylphenyl)carbonyl-3-(5-nitrofuran-2-yl)carbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(4-methylbenzoyl)-3-(5-nitrofuran-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(4-methylphenyl)-oxomethyl]-3-[(5-nitro-2-furanyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(4-methylbenzoyl)-3-(5-nitrofuran-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-(5-nitro-2-furoyl)-3-p-toluoyl-imidazolidine-2-carbonyl]amino]propionic acid Formula: C26H30N4O8 MolecularWeight: 526.5384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C26H30N4O8/c1-16-7-9-18(10-8-16)25(34)28-13-14-29(26(35)20-11-12-21(38-20)30(36)37)24(28)23(33)27-19(15-22(31)32)17-5-3-2-4-6-17/h7-12,17,19,24H,2-6,13-15H2,1H3,(H,27,33)(H,31,32)