3-(3-nitrophenyl)-3-[[1-(oxolan-2-ylcarbonyl)-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(3-nitrophenyl)-3-[[1-(oxolan-2-ylcarbonyl)-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(3-nitrophenyl)-3-[[1-(tetrahydrofuran-2-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(3-nitrophenyl)-3-[[oxo-[1-[oxo(2-oxolanyl)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(3-nitrophenyl)-3-[[1-(oxolane-2-carbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(3-nitrophenyl)-3-[[1-(tetrahydrofuran-2-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H24N4O9S2 MolecularWeight: 552.57736

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CC(OC1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H24N4O9S2/c27-18(28)13-16(14-4-1-5-15(12-14)26(31)32)23-20(29)21-24(22(30)17-6-2-10-35-17)8-9-25(21)37(33,34)19-7-3-11-36-19/h1,3-5,7,11-12,16-17,21H,2,6,8-10,13H2,(H,23,29)(H,27,28)