tert-butyl 2-[[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[1-[(3-methoxy-2-nitrophenyl)methyl]-3-pyrrolidinyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[1-[(3-methoxy-2-nitrophenyl)methyl]pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[1-(3-methoxy-2-nitro-benzyl)pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H32N4O6 MolecularWeight: 448.51268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2CCN(C2)CC3=C(C(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2CCN(C2)CC3=C(C(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O6/c1-22(2,3)32-21(28)25-11-6-8-17(25)20(27)23-16-10-12-24(14-16)13-15-7-5-9-18(31-4)19(15)26(29)30/h5,7,9,16-17H,6,8,10-14H2,1-4H3,(H,23,27)