1-[(3S)-3-benzamido-3-phenyl-propanoyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-[(3S)-3-benzamido-3-phenyl-propanoyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide Openeye Name: 1-[(3S)-3-benzamido-3-phenyl-propanoyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide CAS Name: 1-[(3S)-3-benzamido-1-oxo-3-phenylpropyl]-N-(1,3-benzodioxol-5-yl)-4-piperidinecarboxamide IUPAC Name: 1-[(3S)-3-benzamido-3-phenylpropanoyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide Traditional Name: 1-[(3S)-3-benzamido-3-phenyl-propanoyl]-N-(1,3-benzodioxol-5-yl)isonipecotamide Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)CC(C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C[C@@H](C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O5/c33-27(18-24(20-7-3-1-4-8-20)31-29(35)21-9-5-2-6-10-21)32-15-13-22(14-16-32)28(34)30-23-11-12-25-26(17-23)37-19-36-25/h1-12,17,22,24H,13-16,18-19H2,(H,30,34)(H,31,35)/t24-/m0/s1