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

Systemtic Name: (3S)-N-(diphenylmethyl)-1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-benzhydryl-1-(2-morpholin-4-ium-4-ylethyl)-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-(diphenylmethyl)-1-[2-(4-morpholin-4-iumyl)ethyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-benzhydryl-1-(2-morpholin-4-ium-4-ylethyl)-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-benzhydryl-6-keto-1-(2-morpholin-4-ium-4-ylethyl)nipecotamide Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)CC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)CC[NH+]4CCOCC4

InChI

InChI=1S/C25H31N3O3/c29-23-12-11-22(19-28(23)14-13-27-15-17-31-18-16-27)25(30)26-24(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-10,22,24H,11-19H2,(H,26,30)/p+1/t22-/m0/s1