N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-(2-phenylethanoylamino)butanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-(2-phenylethanoylamino)butanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-1-oxo-2-[(1-oxo-2-phenylethyl)amino]butyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoyl]isonipecotamide Formula: C26H31N3O5 MolecularWeight: 465.54144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O5/c1-17(2)24(28-23(30)14-18-6-4-3-5-7-18)26(32)29-12-10-19(11-13-29)25(31)27-20-8-9-21-22(15-20)34-16-33-21/h3-9,15,17,19,24H,10-14,16H2,1-2H3,(H,27,31)(H,28,30)/t24-/m0/s1