N-[(4-chloranyl-3-nitro-phenyl)methyl]-N-methyl-butan-1-amine

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)methyl]-N-methyl-butan-1-amine Openeye Name: N-[(4-chloro-3-nitro-phenyl)methyl]-N-methyl-butan-1-amine CAS Name: N-[(4-chloro-3-nitrophenyl)methyl]-N-methyl-1-butanamine IUPAC Name: N-[(4-chloro-3-nitrophenyl)methyl]-N-methylbutan-1-amine Traditional Name: butyl-(4-chloro-3-nitro-benzyl)-methyl-amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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