4-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]carbonyl-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 4-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]carbonyl-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-[4-[2-(cyclopropylamino)-2-oxo-ethyl]piperazin-4-ium-1-carbonyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 4-[[4-[2-(cyclopropylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-4-ium-1-carbonyl]-N-phenylpiperidine-1-carboxamide Traditional Name: 4-[4-[2-(cyclopropylamino)-2-keto-ethyl]piperazin-4-ium-1-carbonyl]-N-phenyl-piperidine-1-carboxamide Formula: C22H32N5O3+ MolecularWeight: 414.52118

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H31N5O3/c28-20(23-19-6-7-19)16-25-12-14-26(15-13-25)21(29)17-8-10-27(11-9-17)22(30)24-18-4-2-1-3-5-18/h1-5,17,19H,6-16H2,(H,23,28)(H,24,30)/p+1