2-(3-methoxypropyl)-3-[[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]amino]-3H-isoindol-1-one

Systemtic Name: 2-(3-methoxypropyl)-3-[[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]amino]-3H-isoindol-1-one Openeye Name: 3-[3-(4-benzylpiperidine-1-carbonyl)anilino]-2-(3-methoxypropyl)isoindolin-1-one CAS Name: 2-(3-methoxypropyl)-3-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]anilino]-3H-isoindol-1-one IUPAC Name: 3-[3-(4-benzylpiperidine-1-carbonyl)anilino]-2-(3-methoxypropyl)-3H-isoindol-1-one Traditional Name: 3-[3-(4-benzylpiperidine-1-carbonyl)anilino]-2-(3-methoxypropyl)isoindolin-1-one Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

COCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c1-37-20-8-17-34-29(27-13-5-6-14-28(27)31(34)36)32-26-12-7-11-25(22-26)30(35)33-18-15-24(16-19-33)21-23-9-3-2-4-10-23/h2-7,9-14,22,24,29,32H,8,15-21H2,1H3