N-(4-butylphenyl)-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-(4-butylphenyl)-4-chloranyl-3-nitro-benzamide Openeye Name: N-(4-butylphenyl)-4-chloro-3-nitro-benzamide CAS Name: N-(4-butylphenyl)-4-chloro-3-nitrobenzamide IUPAC Name: N-(4-butylphenyl)-4-chloro-3-nitrobenzamide Traditional Name: N-(4-butylphenyl)-4-chloro-3-nitro-benzamide Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O3/c1-2-3-4-12-5-8-14(9-6-12)19-17(21)13-7-10-15(18)16(11-13)20(22)23/h5-11H,2-4H2,1H3,(H,19,21)