1-(4-butoxy-3-nitro-phenyl)-N-methyl-methanamine

Systemtic Name: 1-(4-butoxy-3-nitro-phenyl)-N-methyl-methanamine Openeye Name: 1-(4-butoxy-3-nitro-phenyl)-N-methyl-methanamine CAS Name: 1-(4-butoxy-3-nitrophenyl)-N-methylmethanamine IUPAC Name: 1-(4-butoxy-3-nitrophenyl)-N-methylmethanamine Traditional Name: (4-butoxy-3-nitro-benzyl)-methyl-amine Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O3/c1-3-4-7-17-12-6-5-10(9-13-2)8-11(12)14(15)16/h5-6,8,13H,3-4,7,9H2,1-2H3