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

Systemtic Name: N-[(4-methoxy-3-nitro-phenyl)methyl]pentan-3-amine Openeye Name: N-[(4-methoxy-3-nitro-phenyl)methyl]pentan-3-amine CAS Name: N-[(4-methoxy-3-nitrophenyl)methyl]-3-pentanamine IUPAC Name: N-[(4-methoxy-3-nitrophenyl)methyl]pentan-3-amine Traditional Name: 1-ethylpropyl-(4-methoxy-3-nitro-benzyl)amine Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O3/c1-4-11(5-2)14-9-10-6-7-13(18-3)12(8-10)15(16)17/h6-8,11,14H,4-5,9H2,1-3H3