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

Systemtic Name: 1-[1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)isoindol-4-yl]-N-ethyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[1,3-dioxo-2-(3-pyridylmethyl)isoindolin-4-yl]-N-ethyl-piperidine-4-carboxamide CAS Name: 1-[1,3-dioxo-2-(3-pyridinylmethyl)-4-isoindolyl]-N-ethyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[1,3-dioxo-2-(pyridin-3-ylmethyl)isoindol-4-yl]-N-ethylpiperidine-4-carboxamide Traditional Name: N-benzyl-1-[1,3-diketo-2-(3-pyridylmethyl)isoindolin-4-yl]-N-ethyl-isonipecotamide Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CN=CC=C5

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CN=CC=C5

InChI

InChI=1S/C29H30N4O3/c1-2-31(19-21-8-4-3-5-9-21)27(34)23-13-16-32(17-14-23)25-12-6-11-24-26(25)29(36)33(28(24)35)20-22-10-7-15-30-18-22/h3-12,15,18,23H,2,13-14,16-17,19-20H2,1H3