(3R)-3-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: (3R)-3-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: (3R)-3-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-N-phenyl-piperidine-1-carboxamide CAS Name: (3R)-3-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-oxomethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: (3R)-3-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-N-phenylpiperidine-1-carboxamide Traditional Name: (3R)-N-phenyl-3-[(piperonyloylamino)carbamoyl]piperidine-1-carboxamide Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N4O5/c26-19(14-8-9-17-18(11-14)30-13-29-17)23-24-20(27)15-5-4-10-25(12-15)21(28)22-16-6-2-1-3-7-16/h1-3,6-9,11,15H,4-5,10,12-13H2,(H,22,28)(H,23,26)(H,24,27)/t15-/m1/s1