5-[[4-[(2S)-butan-2-yl]phenoxy]methyl]-N-(5-nitropyridin-2-yl)furan-2-carboxamide

Systemtic Name: 5-[[4-[(2S)-butan-2-yl]phenoxy]methyl]-N-(5-nitropyridin-2-yl)furan-2-carboxamide Openeye Name: 5-[[4-[(1S)-1-methylpropyl]phenoxy]methyl]-N-(5-nitro-2-pyridyl)furan-2-carboxamide CAS Name: 5-[[4-[(2S)-butan-2-yl]phenoxy]methyl]-N-(5-nitro-2-pyridinyl)-2-furancarboxamide IUPAC Name: 5-[[4-[(2S)-butan-2-yl]phenoxy]methyl]-N-(5-nitropyridin-2-yl)furan-2-carboxamide Traditional Name: 5-[[4-[(1S)-1-methylpropyl]phenoxy]methyl]-N-(5-nitro-2-pyridyl)-2-furamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-3-14(2)15-4-7-17(8-5-15)28-13-18-9-10-19(29-18)21(25)23-20-11-6-16(12-22-20)24(26)27/h4-12,14H,3,13H2,1-2H3,(H,22,23,25)/t14-/m0/s1