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

Systemtic Name: 4-chloranyl-N-[3-(2-methylpropoxy)propyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-(3-isobutoxypropyl)-3-nitro-benzamide CAS Name: 4-chloro-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-(2-methylpropoxy)propyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-(3-isobutoxypropyl)-3-nitro-benzamide Formula: C14H19ClN2O4 MolecularWeight: 314.76466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)COCCCNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H19ClN2O4/c1-10(2)9-21-7-3-6-16-14(18)11-4-5-12(15)13(8-11)17(19)20/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,16,18)