N-(1,3-benzodioxol-5-yl)-1-[(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)methyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(5-oxo-4-phenyl-tetrazol-1-yl)methyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(5-oxo-4-phenyl-1-tetrazolyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(5-oxo-4-phenyltetrazol-1-yl)methyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(5-keto-4-phenyl-tetrazol-1-yl)methyl]isonipecotamide Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CN4C(=O)N(N=N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CN4C(=O)N(N=N4)C5=CC=CC=C5

InChI

InChI=1S/C21H22N6O4/c28-20(22-16-6-7-18-19(12-16)31-14-30-18)15-8-10-25(11-9-15)13-26-21(29)27(24-23-26)17-4-2-1-3-5-17/h1-7,12,15H,8-11,13-14H2,(H,22,28)