N-(1,3-benzodioxol-5-ylmethyl)-1,2-bis(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1,2-bis(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1,2-bis(4-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1,2-bis(4-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1,2-bis(4-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: 6-keto-1,2-bis(4-methoxyphenyl)-N-piperonyl-nipecotamide Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H28N2O6/c1-33-21-8-4-19(5-9-21)27-23(12-14-26(31)30(27)20-6-10-22(34-2)11-7-20)28(32)29-16-18-3-13-24-25(15-18)36-17-35-24/h3-11,13,15,23,27H,12,14,16-17H2,1-2H3,(H,29,32)