N-butyl-2-[4-[(3-ethoxy-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[(3-ethoxy-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[(3-ethoxy-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-butyl-2-[4-[(3-ethoxy-2-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-butyl-2-[4-[(3-ethoxy-2-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-butyl-2-[4-(3-ethoxy-2-methoxy-benzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H35N3O3+2 MolecularWeight: 365.5102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C(=CC=C2)OCC)OC

Isomeric SMILES

CCCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C(=CC=C2)OCC)OC

InChI

InChI=1S/C20H33N3O3/c1-4-6-10-21-19(24)16-23-13-11-22(12-14-23)15-17-8-7-9-18(26-5-2)20(17)25-3/h7-9H,4-6,10-16H2,1-3H3,(H,21,24)/p+2