N-cyclopropyl-2-[4-(4-phenylmethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(4-phenylmethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-benzyloxybenzoyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-(4-phenylmethoxyphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(4-phenylmethoxybenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(4-benzoxybenzoyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3/c27-22(24-20-8-9-20)16-25-12-14-26(15-13-25)23(28)19-6-10-21(11-7-19)29-17-18-4-2-1-3-5-18/h1-7,10-11,20H,8-9,12-17H2,(H,24,27)/p+1