N-(1,3-benzodioxol-5-ylmethyl)-1-[1-(4-butylphenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[1-(4-butylphenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[1-(4-butylbenzoyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[1-[(4-butylphenyl)-oxomethyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[1-(4-butylbenzoyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[1-(4-butylbenzoyl)-4-piperidyl]-N-piperonyl-isonipecotamide Formula: C30H39N3O4 MolecularWeight: 505.64836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H39N3O4/c1-2-3-4-22-5-8-25(9-6-22)30(35)33-17-13-26(14-18-33)32-15-11-24(12-16-32)29(34)31-20-23-7-10-27-28(19-23)37-21-36-27/h5-10,19,24,26H,2-4,11-18,20-21H2,1H3,(H,31,34)