N-[5-(2,3-dimethoxyphenoxy)-2,4-dinitro-phenyl]piperidin-1-amine

Systemtic Name: N-[5-(2,3-dimethoxyphenoxy)-2,4-dinitro-phenyl]piperidin-1-amine Openeye Name: N-[5-(2,3-dimethoxyphenoxy)-2,4-dinitro-phenyl]piperidin-1-amine CAS Name: N-[5-(2,3-dimethoxyphenoxy)-2,4-dinitrophenyl]-1-piperidinamine IUPAC Name: N-[5-(2,3-dimethoxyphenoxy)-2,4-dinitrophenyl]piperidin-1-amine Traditional Name: [5-(2,3-dimethoxyphenoxy)-2,4-dinitro-phenyl]-piperidino-amine Formula: C19H22N4O7 MolecularWeight: 418.40058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1OC)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O7/c1-28-16-7-6-8-17(19(16)29-2)30-18-11-13(20-21-9-4-3-5-10-21)14(22(24)25)12-15(18)23(26)27/h6-8,11-12,20H,3-5,9-10H2,1-2H3