(3S)-1-cyclopropyl-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-cyclopropyl-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-cyclopropyl-5-oxo-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-cyclopropyl-5-oxo-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-cyclopropyl-5-oxo-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-cyclopropyl-5-keto-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyrrolidine-3-carboxamide Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2CC(CC2=O)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC1N2C[C@H](CC2=O)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H28N4O2/c25-19-14-16(15-24(19)18-6-7-18)20(26)21-8-9-22-10-12-23(13-11-22)17-4-2-1-3-5-17/h1-5,16,18H,6-15H2,(H,21,26)/p+1/t16-/m0/s1