3-methoxy-N-[(4-methyl-3-nitro-phenyl)methyl]propan-1-amine

Systemtic Name: 3-methoxy-N-[(4-methyl-3-nitro-phenyl)methyl]propan-1-amine Openeye Name: 3-methoxy-N-[(4-methyl-3-nitro-phenyl)methyl]propan-1-amine CAS Name: 3-methoxy-N-[(4-methyl-3-nitrophenyl)methyl]-1-propanamine IUPAC Name: 3-methoxy-N-[(4-methyl-3-nitrophenyl)methyl]propan-1-amine Traditional Name: 3-methoxypropyl-(4-methyl-3-nitro-benzyl)amine Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNCCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CNCCCOC)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O3/c1-10-4-5-11(8-12(10)14(15)16)9-13-6-3-7-17-2/h4-5,8,13H,3,6-7,9H2,1-2H3