7-(4-methanoyl-3-nitro-phenoxy)-N-(1-methylpiperazin-1-ium-1-yl)heptanamide

Systemtic Name: 7-(4-methanoyl-3-nitro-phenoxy)-N-(1-methylpiperazin-1-ium-1-yl)heptanamide Openeye Name: 7-(4-formyl-3-nitro-phenoxy)-N-(1-methylpiperazin-1-ium-1-yl)heptanamide CAS Name: 7-(4-formyl-3-nitrophenoxy)-N-(1-methyl-1-piperazin-1-iumyl)heptanamide IUPAC Name: 7-(4-formyl-3-nitrophenoxy)-N-(1-methylpiperazin-1-ium-1-yl)heptanamide Traditional Name: 7-(4-formyl-3-nitro-phenoxy)-N-(1-methylpiperazin-1-ium-1-yl)enanthamide Formula: C19H29N4O5+ MolecularWeight: 393.45736

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)NC(=O)CCCCCCOC2=CC(=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

C[N+]1(CCNCC1)NC(=O)CCCCCCOC2=CC(=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C19H28N4O5/c1-23(11-9-20-10-12-23)21-19(25)6-4-2-3-5-13-28-17-8-7-16(15-24)18(14-17)22(26)27/h7-8,14-15,20H,2-6,9-13H2,1H3/p+1