2-(3-methoxypropyl)-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(3-methoxypropyl)-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxypropyl)isoindoline-1,3-dione CAS Name: 2-(3-methoxypropyl)-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]isoindole-1,3-dione IUPAC Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxypropyl)isoindole-1,3-dione Traditional Name: 5-(4-benzylpiperidine-1-carbonyl)-2-(3-methoxypropyl)isoindoline-1,3-quinone Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4/c1-31-15-5-12-27-24(29)21-9-8-20(17-22(21)25(27)30)23(28)26-13-10-19(11-14-26)16-18-6-3-2-4-7-18/h2-4,6-9,17,19H,5,10-16H2,1H3