N-[2,4-dinitro-5-(4-propylphenoxy)phenyl]piperidin-1-amine

Systemtic Name: N-[2,4-dinitro-5-(4-propylphenoxy)phenyl]piperidin-1-amine Openeye Name: N-[2,4-dinitro-5-(4-propylphenoxy)phenyl]piperidin-1-amine CAS Name: N-[2,4-dinitro-5-(4-propylphenoxy)phenyl]-1-piperidinamine IUPAC Name: N-[2,4-dinitro-5-(4-propylphenoxy)phenyl]piperidin-1-amine Traditional Name: [2,4-dinitro-5-(4-propylphenoxy)phenyl]-piperidino-amine Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5/c1-2-6-15-7-9-16(10-8-15)29-20-13-17(21-22-11-4-3-5-12-22)18(23(25)26)14-19(20)24(27)28/h7-10,13-14,21H,2-6,11-12H2,1H3