N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-nitro-benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-nitro-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-nitro-benzamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-4-nitrobenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-4-nitrobenzamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-4-nitro-benzamide Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N2O5/c1-3-4-11-26-17-10-5-14(12-18(17)25-2)13-20-19(22)15-6-8-16(9-7-15)21(23)24/h5-10,12H,3-4,11,13H2,1-2H3,(H,20,22)