N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]pentanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]pentanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]pentanamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]pentanamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]pentanamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]valeramide Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)N2CC[NH+](CC2)CC)C

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)N2CC[NH+](CC2)CC)C

InChI

InChI=1S/C18H29N3O/c1-4-6-7-18(22)19-17-9-8-16(14-15(17)3)21-12-10-20(5-2)11-13-21/h8-9,14H,4-7,10-13H2,1-3H3,(H,19,22)/p+1