2-[(2S)-1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[(2S)-1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[(1S)-2-[4-(3-methoxyphenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]isoindolin-1-one CAS Name: 2-[(2S)-1-[4-(3-methoxyphenyl)-1-piperazinyl]-1-oxopropan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[(2S)-1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[(1S)-2-keto-2-[4-(3-methoxyphenyl)piperazino]-1-methyl-ethyl]isoindolin-1-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)OC)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC(=CC=C2)OC)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H25N3O3/c1-16(25-15-17-6-3-4-9-20(17)22(25)27)21(26)24-12-10-23(11-13-24)18-7-5-8-19(14-18)28-2/h3-9,14,16H,10-13,15H2,1-2H3/t16-/m0/s1