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

Systemtic Name: (3S)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-benzyl-1-(2-morpholin-4-ium-4-ylethyl)-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-1-[2-(4-morpholin-4-iumyl)ethyl]-6-oxo-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-benzyl-1-(2-morpholin-4-ium-4-ylethyl)-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-benzyl-6-keto-1-(2-morpholin-4-ium-4-ylethyl)nipecotamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCC2=CC=CC=C2)CC[NH+]3CCOCC3

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCC2=CC=CC=C2)CC[NH+]3CCOCC3

InChI

InChI=1S/C19H27N3O3/c23-18-7-6-17(19(24)20-14-16-4-2-1-3-5-16)15-22(18)9-8-21-10-12-25-13-11-21/h1-5,17H,6-15H2,(H,20,24)/p+1/t17-/m0/s1