N-(1,3-dioxolan-2-ylmethyl)-4-hexoxy-2,6-dinitro-N-pent-4-enyl-aniline

Systemtic Name: N-(1,3-dioxolan-2-ylmethyl)-4-hexoxy-2,6-dinitro-N-pent-4-enyl-aniline Openeye Name: N-(1,3-dioxolan-2-ylmethyl)-4-hexoxy-2,6-dinitro-N-pent-4-enyl-aniline CAS Name: N-(1,3-dioxolan-2-ylmethyl)-4-hexoxy-2,6-dinitro-N-pent-4-enylaniline IUPAC Name: N-(1,3-dioxolan-2-ylmethyl)-4-hexoxy-2,6-dinitro-N-pent-4-enylaniline Traditional Name: 1,3-dioxolan-2-ylmethyl-(4-hexoxy-2,6-dinitro-phenyl)-pent-4-enyl-amine Formula: C21H31N3O7 MolecularWeight: 437.48674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C(=C1)[N+](=O)[O-])N(CCCC=C)CC2OCCO2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC(=C(C(=C1)[N+](=O)[O-])N(CCCC=C)CC2OCCO2)[N+](=O)[O-]

InChI

InChI=1S/C21H31N3O7/c1-3-5-7-9-11-29-17-14-18(23(25)26)21(19(15-17)24(27)28)22(10-8-6-4-2)16-20-30-12-13-31-20/h4,14-15,20H,2-3,5-13,16H2,1H3