3-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2-phenoxyphenyl)propanamide

Systemtic Name: 3-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2-phenoxyphenyl)propanamide Openeye Name: 3-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2-phenoxyphenyl)propanamide CAS Name: 3-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2-phenoxyphenyl)propanamide IUPAC Name: 3-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2-phenoxyphenyl)propanamide Traditional Name: 3-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2-phenoxyphenyl)propionamide Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

InChI

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