4-(4-ethoxyphenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(4-ethoxyphenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-oxidanylidene-butanamide Openeye Name: 4-(4-ethoxyphenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-oxo-butanamide CAS Name: 4-(4-ethoxyphenyl)-N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-4-oxobutanamide IUPAC Name: 4-(4-ethoxyphenyl)-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-oxobutanamide Traditional Name: 4-keto-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-p-phenetyl-butyramide Formula: C20H33N3O3+2 MolecularWeight: 363.49432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NCCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NCCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C20H31N3O3/c1-3-26-18-7-5-17(6-8-18)19(24)9-10-20(25)21-11-4-12-23-15-13-22(2)14-16-23/h5-8H,3-4,9-16H2,1-2H3,(H,21,25)/p+2