(3S)-N-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-1-(3-phenylpropyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-1-(3-phenylpropyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-morpholin-4-ium-4-ylethyl)-6-oxo-1-(3-phenylpropyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(4-morpholin-4-iumyl)ethyl]-6-oxo-1-(3-phenylpropyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-morpholin-4-ium-4-ylethyl)-6-oxo-1-(3-phenylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-N-(2-morpholin-4-ium-4-ylethyl)-1-(3-phenylpropyl)nipecotamide Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCC[NH+]2CCOCC2)CCCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCC[NH+]2CCOCC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H31N3O3/c25-20-9-8-19(21(26)22-10-12-23-13-15-27-16-14-23)17-24(20)11-4-7-18-5-2-1-3-6-18/h1-3,5-6,19H,4,7-17H2,(H,22,26)/p+1/t19-/m0/s1