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

Systemtic Name: N-butyl-2-(chloromethyl)-N-methyl-4-nitro-aniline Openeye Name: N-butyl-2-(chloromethyl)-N-methyl-4-nitro-aniline CAS Name: N-butyl-2-(chloromethyl)-N-methyl-4-nitroaniline IUPAC Name: N-butyl-2-(chloromethyl)-N-methyl-4-nitroaniline Traditional Name: butyl-[2-(chloromethyl)-4-nitro-phenyl]-methyl-amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClN2O2/c1-3-4-7-14(2)12-6-5-11(15(16)17)8-10(12)9-13/h5-6,8H,3-4,7,9H2,1-2H3