N-[(3-nitro-4-propan-2-yloxy-phenyl)methyl]cyclopropanamine

Systemtic Name: N-[(3-nitro-4-propan-2-yloxy-phenyl)methyl]cyclopropanamine Openeye Name: N-[(4-isopropoxy-3-nitro-phenyl)methyl]cyclopropanamine CAS Name: N-[(3-nitro-4-propan-2-yloxyphenyl)methyl]cyclopropanamine IUPAC Name: N-[(3-nitro-4-propan-2-yloxyphenyl)methyl]cyclopropanamine Traditional Name: cyclopropyl-(4-isopropoxy-3-nitro-benzyl)amine Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CNC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CNC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O3/c1-9(2)18-13-6-3-10(7-12(13)15(16)17)8-14-11-4-5-11/h3,6-7,9,11,14H,4-5,8H2,1-2H3