4-ethyl-3,5-dinitro-benzaldehyde; methanamine

Systemtic Name: 4-ethyl-3,5-dinitro-benzaldehyde; methanamine Openeye Name: 4-ethyl-3,5-dinitro-benzaldehyde; methanamine CAS Name: 4-ethyl-3,5-dinitrobenzaldehyde; methanamine IUPAC Name: 4-ethyl-3,5-dinitrobenzaldehyde; methanamine Traditional Name: 4-ethyl-3,5-dinitro-benzaldehyde; methylamine Formula: C10H13N3O5 MolecularWeight: 255.22732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1[N+](=O)[O-])C=O)[N+](=O)[O-].CN

Isomeric SMILES

CCC1=C(C=C(C=C1[N+](=O)[O-])C=O)[N+](=O)[O-].CN

InChI

InChI=1S/C9H8N2O5.CH5N/c1-2-7-8(10(13)14)3-6(5-12)4-9(7)11(15)16;1-2/h3-5H,2H2,1H3;2H2,1H3