(1-azanyl-2-methyl-1-oxidanylidene-pentan-2-yl) 3-[4-(5-bromanylpyridin-2-yl)oxy-3-methyl-phenyl]-2-nitro-benzenecarboximidate

Systemtic Name: (1-azanyl-2-methyl-1-oxidanylidene-pentan-2-yl) 3-[4-(5-bromanylpyridin-2-yl)oxy-3-methyl-phenyl]-2-nitro-benzenecarboximidate Openeye Name: (1-carbamoyl-1-methyl-butyl) 3-[4-[(5-bromo-2-pyridyl)oxy]-3-methyl-phenyl]-2-nitro-benzenecarboximidate CAS Name: 3-[4-[(5-bromo-2-pyridinyl)oxy]-3-methylphenyl]-2-nitrobenzenecarboximidic acid (1-amino-2-methyl-1-oxopentan-2-yl) ester IUPAC Name: (1-amino-2-methyl-1-oxopentan-2-yl) 3-[4-(5-bromopyridin-2-yl)oxy-3-methylphenyl]-2-nitrobenzenecarboximidate Traditional Name: 3-[4-[(5-bromo-2-pyridyl)oxy]-3-methyl-phenyl]-2-nitro-benzenecarboximidic acid (1-carbamoyl-1-methyl-butyl) ester Formula: C25H25BrN4O5 MolecularWeight: 541.3938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)N)OC(=N)C1=CC=CC(=C1[N+](=O)[O-])C2=CC(=C(C=C2)OC3=NC=C(C=C3)Br)C

Isomeric SMILES

CCCC(C)(C(=O)N)OC(=N)C1=CC=CC(=C1[N+](=O)[O-])C2=CC(=C(C=C2)OC3=NC=C(C=C3)Br)C

InChI

InChI=1S/C25H25BrN4O5/c1-4-12-25(3,24(28)31)35-23(27)19-7-5-6-18(22(19)30(32)33)16-8-10-20(15(2)13-16)34-21-11-9-17(26)14-29-21/h5-11,13-14,27H,4,12H2,1-3H3,(H2,28,31)