3-[[2-(3-methoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 3-[[2-(3-methoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-[[2-(3-methoxypropyl)-3-oxo-isoindolin-1-yl]amino]benzamide CAS Name: 3-[[2-(3-methoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-[[2-(3-methoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-[[3-keto-2-(3-methoxypropyl)isoindolin-1-yl]amino]benzamide Formula: C31H36N4O3 MolecularWeight: 512.64254

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H36N4O3/c1-38-20-8-17-35-29(27-13-5-6-14-28(27)31(35)37)32-26-12-7-11-24(21-26)30(36)33-25-15-18-34(19-16-25)22-23-9-3-2-4-10-23/h2-7,9-14,21,25,29,32H,8,15-20,22H2,1H3,(H,33,36)