N,N-diethyl-2-[4-(4-phenoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-(4-phenoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-(4-phenoxybenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[oxo-(4-phenoxyphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-(4-phenoxybenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-(4-phenoxybenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c1-3-25(4-2)22(27)18-24-14-16-26(17-15-24)23(28)19-10-12-21(13-11-19)29-20-8-6-5-7-9-20/h5-13H,3-4,14-18H2,1-2H3/p+1