2-[(2S)-1-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[(2S)-1-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[(1S)-1-[4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carbonyl]-3-methyl-butyl]isoindolin-1-one CAS Name: 2-[(2S)-1-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-4-methyl-1-oxopentan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[(2S)-1-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-4-methyl-1-oxopentan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[(1S)-1-[4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carbonyl]-3-methyl-butyl]isoindolin-1-one Formula: C25H29ClN2O3 MolecularWeight: 440.96236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCC(CC1)(C2=CC=C(C=C2)Cl)O)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCC(CC1)(C2=CC=C(C=C2)Cl)O)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H29ClN2O3/c1-17(2)15-22(28-16-18-5-3-4-6-21(18)23(28)29)24(30)27-13-11-25(31,12-14-27)19-7-9-20(26)10-8-19/h3-10,17,22,31H,11-16H2,1-2H3/t22-/m0/s1