tert-butyl N-[2-[4-[(3-nitropyridin-2-yl)amino]phenyl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[4-[(3-nitropyridin-2-yl)amino]phenyl]ethyl]carbamate Openeye Name: tert-butyl N-[2-[4-[(3-nitro-2-pyridyl)amino]phenyl]ethyl]carbamate CAS Name: N-[2-[4-[(3-nitro-2-pyridinyl)amino]phenyl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-[(3-nitropyridin-2-yl)amino]phenyl]ethyl]carbamate Traditional Name: N-[2-[4-[(3-nitro-2-pyridyl)amino]phenyl]ethyl]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)NCCC1=CC=C(C=C1)NC2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)NC2=C(C=CC=N2)[N+](=O)[O-]

InChI

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