[5-butoxy-4-[4-(2-ethylhexanoyl)piperazin-1-yl]-2-methyl-phenyl]iminoazanium

Systemtic Name: [5-butoxy-4-[4-(2-ethylhexanoyl)piperazin-1-yl]-2-methyl-phenyl]iminoazanium Openeye Name: [5-butoxy-4-[4-(2-ethylhexanoyl)piperazin-1-yl]-2-methyl-phenyl]iminoammonium CAS Name: [5-butoxy-4-[4-(2-ethyl-1-oxohexyl)-1-piperazinyl]-2-methylphenyl]iminoammonium IUPAC Name: [5-butoxy-4-[4-(2-ethylhexanoyl)piperazin-1-yl]-2-methylphenyl]iminoazanium Traditional Name: [5-butoxy-4-[4-(2-ethylhexanoyl)piperazino]-2-methyl-phenyl]iminoammonium Formula: C23H39N4O2+ MolecularWeight: 403.58136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C2=C(C=C(C(=C2)C)N=[NH2+])OCCCC

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C2=C(C=C(C(=C2)C)N=[NH2+])OCCCC

InChI

InChI=1S/C23H38N4O2/c1-5-8-10-19(7-3)23(28)27-13-11-26(12-14-27)21-16-18(4)20(25-24)17-22(21)29-15-9-6-2/h16-17,19,24H,5-15H2,1-4H3/p+1