1-[1-azanyl-4-oxidanylidene-4-(2-oxidanylidene-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[1-azanyl-4-oxidanylidene-4-(2-oxidanylidene-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[1-amino-4-oxo-4-(2-oxo-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[1-amino-4-oxo-4-(2-oxo-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[1-amino-4-oxo-4-(2-oxo-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[1-amino-4-keto-4-(2-keto-4-phenyl-1,3-oxazinan-3-yl)butyl]-4-phenyl-isonipecotic acid Formula: C26H31N3O5 MolecularWeight: 465.54144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)N(C1C2=CC=CC=C2)C(=O)CCC(N)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1COC(=O)N(C1C2=CC=CC=C2)C(=O)CCC(N)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H31N3O5/c27-22(28-16-14-26(15-17-28,24(31)32)20-9-5-2-6-10-20)11-12-23(30)29-21(13-18-34-25(29)33)19-7-3-1-4-8-19/h1-10,21-22H,11-18,27H2,(H,31,32)