3-[[1-(4-bromophenyl)carbonyl-3-(3-methoxyphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-cyclohexyl-propanoic acid

Systemtic Name: 3-[[1-(4-bromophenyl)carbonyl-3-(3-methoxyphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-cyclohexyl-propanoic acid Openeye Name: 3-[[1-(4-bromobenzoyl)-3-(3-methoxybenzoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[[1-[(4-bromophenyl)-oxomethyl]-3-[(3-methoxyphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[[1-(4-bromobenzoyl)-3-(3-methoxybenzoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-(4-bromobenzoyl)-3-m-anisoyl-imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C28H32BrN3O6 MolecularWeight: 586.47418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H32BrN3O6/c1-38-22-9-5-8-20(16-22)28(37)32-15-14-31(27(36)19-10-12-21(29)13-11-19)26(32)25(35)30-23(17-24(33)34)18-6-3-2-4-7-18/h5,8-13,16,18,23,26H,2-4,6-7,14-15,17H2,1H3,(H,30,35)(H,33,34)