1-[1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindol-4-yl]-N-butyl-N-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-[1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindol-4-yl]-N-butyl-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-benzyl-N-butyl-1-[1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindolin-4-yl]piperidine-3-carboxamide CAS Name: N-butyl-1-[1,3-dioxo-2-(2-oxolanylmethyl)-4-isoindolyl]-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-benzyl-N-butyl-1-[1,3-dioxo-2-(oxolan-2-ylmethyl)isoindol-4-yl]piperidine-3-carboxamide Traditional Name: N-benzyl-N-butyl-1-[1,3-diketo-2-(tetrahydrofurfuryl)isoindolin-4-yl]nipecotamide Formula: C30H37N3O4 MolecularWeight: 503.63248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)CC5CCCO5

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)CC5CCCO5

InChI

InChI=1S/C30H37N3O4/c1-2-3-16-32(19-22-10-5-4-6-11-22)28(34)23-12-8-17-31(20-23)26-15-7-14-25-27(26)30(36)33(29(25)35)21-24-13-9-18-37-24/h4-7,10-11,14-15,23-24H,2-3,8-9,12-13,16-21H2,1H3