N-[(3-nitro-4-pentoxy-phenyl)methyl]cyclopropanamine

Systemtic Name: N-[(3-nitro-4-pentoxy-phenyl)methyl]cyclopropanamine Openeye Name: N-[(3-nitro-4-pentoxy-phenyl)methyl]cyclopropanamine CAS Name: N-[(3-nitro-4-pentoxyphenyl)methyl]cyclopropanamine IUPAC Name: N-[(3-nitro-4-pentoxyphenyl)methyl]cyclopropanamine Traditional Name: (4-amoxy-3-nitro-benzyl)-cyclopropyl-amine Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)CNC2CC2)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)CNC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-2-3-4-9-20-15-8-5-12(10-14(15)17(18)19)11-16-13-6-7-13/h5,8,10,13,16H,2-4,6-7,9,11H2,1H3