3-methyl-N-[3-(2-methylpropoxy)propyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[3-(2-methylpropoxy)propyl]-4-nitro-benzamide Openeye Name: N-(3-isobutoxypropyl)-3-methyl-4-nitro-benzamide CAS Name: 3-methyl-N-[3-(2-methylpropoxy)propyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[3-(2-methylpropoxy)propyl]-4-nitrobenzamide Traditional Name: N-(3-isobutoxypropyl)-3-methyl-4-nitro-benzamide Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCOCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCOCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O4/c1-11(2)10-21-8-4-7-16-15(18)13-5-6-14(17(19)20)12(3)9-13/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,16,18)