N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4)N5CCCCC5

InChI

InChI=1S/C28H33N3O5/c1-35-21-10-7-19(8-11-21)25(30-13-3-2-4-14-30)17-29-26(32)20-9-12-23-24(16-20)28(34)31(27(23)33)18-22-6-5-15-36-22/h7-12,16,22,25H,2-6,13-15,17-18H2,1H3,(H,29,32)