tert-butyl N-[4-[2-(methylamino)-3-nitro-pyridin-4-yl]oxynaphthalen-1-yl]carbamate

Systemtic Name: tert-butyl N-[4-[2-(methylamino)-3-nitro-pyridin-4-yl]oxynaphthalen-1-yl]carbamate Openeye Name: tert-butyl N-[4-[[2-(methylamino)-3-nitro-4-pyridyl]oxy]-1-naphthyl]carbamate CAS Name: N-[4-[[2-(methylamino)-3-nitro-4-pyridinyl]oxy]-1-naphthalenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-(methylamino)-3-nitropyridin-4-yl]oxynaphthalen-1-yl]carbamate Traditional Name: N-[4-[[2-(methylamino)-3-nitro-4-pyridyl]oxy]-1-naphthyl]carbamic acid tert-butyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C2=CC=CC=C21)OC3=C(C(=NC=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C2=CC=CC=C21)OC3=C(C(=NC=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O5/c1-21(2,3)30-20(26)24-15-9-10-16(14-8-6-5-7-13(14)15)29-17-11-12-23-19(22-4)18(17)25(27)28/h5-12H,1-4H3,(H,22,23)(H,24,26)