N-[(5-nitro-2-propan-2-yloxy-phenyl)methyl]cyclopropanamine

Systemtic Name: N-[(5-nitro-2-propan-2-yloxy-phenyl)methyl]cyclopropanamine Openeye Name: N-[(2-isopropoxy-5-nitro-phenyl)methyl]cyclopropanamine CAS Name: N-[(5-nitro-2-propan-2-yloxyphenyl)methyl]cyclopropanamine IUPAC Name: N-[(5-nitro-2-propan-2-yloxyphenyl)methyl]cyclopropanamine Traditional Name: cyclopropyl-(2-isopropoxy-5-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)[N+](=O)[O-])CNC2CC2

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3/c1-9(2)18-13-6-5-12(15(16)17)7-10(13)8-14-11-3-4-11/h5-7,9,11,14H,3-4,8H2,1-2H3