N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopentane-1-carboxamide

Systemtic Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopentane-1-carboxamide Openeye Name: N-[(1S)-2-(1,3-benzodioxol-5-ylmethylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-1-phenyl-cyclopentanecarboxamide CAS Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-1-phenyl-1-cyclopentanecarboxamide IUPAC Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-1-phenylcyclopentane-1-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-(piperonylamino)ethyl]-1-phenyl-cyclopentanecarboxamide Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CC=C2)C(=O)NC(CO)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(C1)(C2=CC=CC=C2)C(=O)N[C@@H](CO)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26N2O5/c26-14-18(21(27)24-13-16-8-9-19-20(12-16)30-15-29-19)25-22(28)23(10-4-5-11-23)17-6-2-1-3-7-17/h1-3,6-9,12,18,26H,4-5,10-11,13-15H2,(H,24,27)(H,25,28)/t18-/m0/s1