tert-butyl N-[4-(3-azanyl-5-nitro-phenyl)pyridin-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-(3-azanyl-5-nitro-phenyl)pyridin-2-yl]carbamate Openeye Name: tert-butyl N-[4-(3-amino-5-nitro-phenyl)-2-pyridyl]carbamate CAS Name: N-[4-(3-amino-5-nitrophenyl)-2-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(3-amino-5-nitrophenyl)pyridin-2-yl]carbamate Traditional Name: N-[4-(3-amino-5-nitro-phenyl)-2-pyridyl]carbamic acid tert-butyl ester Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC=CC(=C1)C2=CC(=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC=CC(=C1)C2=CC(=CC(=C2)[N+](=O)[O-])N

InChI

InChI=1S/C16H18N4O4/c1-16(2,3)24-15(21)19-14-8-10(4-5-18-14)11-6-12(17)9-13(7-11)20(22)23/h4-9H,17H2,1-3H3,(H,18,19,21)