N-[(4-butoxy-3-methoxy-phenyl)methyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-2-chloro-5-nitro-benzamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-2-chloro-5-nitrobenzamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-2-chloro-5-nitro-benzamide Formula: C19H21ClN2O5 MolecularWeight: 392.83344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O5/c1-3-4-9-27-17-8-5-13(10-18(17)26-2)12-21-19(23)15-11-14(22(24)25)6-7-16(15)20/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,21,23)