N-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-methyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: N-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-methyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidyl]methyl]-3-methyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidinyl]methyl]-3-methyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-methyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: N-[[1-(2,5-dimethylbenzyl)-4-piperidyl]methyl]-2-(1-ketoisoindolin-2-yl)-3-methyl-butyramide Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCC(CC2)CNC(=O)C(C(C)C)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCC(CC2)CNC(=O)C(C(C)C)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C28H37N3O2/c1-19(2)26(31-18-23-7-5-6-8-25(23)28(31)33)27(32)29-16-22-11-13-30(14-12-22)17-24-15-20(3)9-10-21(24)4/h5-10,15,19,22,26H,11-14,16-18H2,1-4H3,(H,29,32)