N-butyl-4-(chloromethyl)-N-ethyl-2-nitro-aniline

Systemtic Name: N-butyl-4-(chloromethyl)-N-ethyl-2-nitro-aniline Openeye Name: N-butyl-4-(chloromethyl)-N-ethyl-2-nitro-aniline CAS Name: N-butyl-4-(chloromethyl)-N-ethyl-2-nitroaniline IUPAC Name: N-butyl-4-(chloromethyl)-N-ethyl-2-nitroaniline Traditional Name: butyl-[4-(chloromethyl)-2-nitro-phenyl]-ethyl-amine Formula: C13H19ClN2O2 MolecularWeight: 270.75516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=C(C=C(C=C1)CCl)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC)C1=C(C=C(C=C1)CCl)[N+](=O)[O-]

InChI

InChI=1S/C13H19ClN2O2/c1-3-5-8-15(4-2)12-7-6-11(10-14)9-13(12)16(17)18/h6-7,9H,3-5,8,10H2,1-2H3