N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-butan-2-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-butan-2-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-butan-2-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-2-butanamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methylbutan-2-amine Traditional Name: (2-chloro-5-nitro-benzyl)-methyl-sec-butyl-amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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