tert-butyl N-[1-(6-nitroquinolin-2-yl)pyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(6-nitroquinolin-2-yl)pyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-(6-nitro-2-quinolyl)pyrrolidin-3-yl]carbamate CAS Name: N-[1-(6-nitro-2-quinolinyl)-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(6-nitroquinolin-2-yl)pyrrolidin-3-yl]carbamate Traditional Name: N-[1-(6-nitro-2-quinolyl)pyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)C2=NC3=C(C=C2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C1)C2=NC3=C(C=C2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4/c1-18(2,3)26-17(23)19-13-8-9-21(11-13)16-7-4-12-10-14(22(24)25)5-6-15(12)20-16/h4-7,10,13H,8-9,11H2,1-3H3,(H,19,23)