2-[3-oxidanylidene-3-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]propyl]-3H-isoindol-1-one

Systemtic Name: 2-[3-oxidanylidene-3-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]propyl]-3H-isoindol-1-one Openeye Name: 2-[3-[(3S)-3-(4-isopropylanilino)-1-piperidyl]-3-oxo-propyl]isoindolin-1-one CAS Name: 2-[3-oxo-3-[(3S)-3-(4-propan-2-ylanilino)-1-piperidinyl]propyl]-3H-isoindol-1-one IUPAC Name: 2-[3-oxo-3-[(3S)-3-(4-propan-2-ylanilino)piperidin-1-yl]propyl]-3H-isoindol-1-one Traditional Name: 2-[3-[(3S)-3-cumidinopiperidino]-3-keto-propyl]isoindolin-1-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CCN3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N[C@H]2CCCN(C2)C(=O)CCN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H31N3O2/c1-18(2)19-9-11-21(12-10-19)26-22-7-5-14-27(17-22)24(29)13-15-28-16-20-6-3-4-8-23(20)25(28)30/h3-4,6,8-12,18,22,26H,5,7,13-17H2,1-2H3/t22-/m0/s1