N-cyclopropyl-2-[4-(3,4,5-triethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(3,4,5-triethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-(3,4,5-triethoxyphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(3,4,5-triethoxybenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C22H34N3O5+ MolecularWeight: 420.52246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C22H33N3O5/c1-4-28-18-13-16(14-19(29-5-2)21(18)30-6-3)22(27)25-11-9-24(10-12-25)15-20(26)23-17-7-8-17/h13-14,17H,4-12,15H2,1-3H3,(H,23,26)/p+1