(3S)-1-(2-benzamidoethanoyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2-benzamidoethanoyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2-benzamidoacetyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide CAS Name: (3S)-1-(2-benzamido-1-oxoethyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2-benzamidoacetyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide Traditional Name: (3S)-1-hippuroyl-N-piperonyl-nipecotamide Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CNC(=O)C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CNC(=O)C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N3O5/c27-21(13-25-22(28)17-5-2-1-3-6-17)26-10-4-7-18(14-26)23(29)24-12-16-8-9-19-20(11-16)31-15-30-19/h1-3,5-6,8-9,11,18H,4,7,10,12-15H2,(H,24,29)(H,25,28)/t18-/m0/s1