[3-[(4-nitrophenyl)sulfonyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]amino]-3-phenylmethoxy-propyl]carbamic acid

Systemtic Name: [3-[(4-nitrophenyl)sulfonyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]amino]-3-phenylmethoxy-propyl]carbamic acid Openeye Name: [3-benzyloxy-3-[(4-nitrophenyl)sulfonyl-[(2-oxopyrrolidin-1-yl)methyl]amino]propyl]carbamic acid CAS Name: [3-[(4-nitrophenyl)sulfonyl-[(2-oxo-1-pyrrolidinyl)methyl]amino]-3-phenylmethoxypropyl]carbamic acid IUPAC Name: [3-[(4-nitrophenyl)sulfonyl-[(2-oxopyrrolidin-1-yl)methyl]amino]-3-phenylmethoxypropyl]carbamic acid Traditional Name: [3-benzoxy-3-[(2-ketopyrrolidino)methyl-nosyl-amino]propyl]carbamic acid Formula: C22H26N4O8S MolecularWeight: 506.52884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CN(C(CCNC(=O)O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CN(C(CCNC(=O)O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O8S/c27-20-7-4-14-24(20)16-25(35(32,33)19-10-8-18(9-11-19)26(30)31)21(12-13-23-22(28)29)34-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,21,23H,4,7,12-16H2,(H,28,29)