5-[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione Openeye Name: 5-[(3S)-3-(4-methoxyanilino)piperidine-1-carbonyl]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[[(3S)-3-(4-methoxyanilino)-1-piperidinyl]-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-[(3S)-3-(4-methoxyanilino)piperidine-1-carbonyl]-2-methylisoindole-1,3-dione Traditional Name: 2-methyl-5-[(3S)-3-(p-anisidino)piperidine-1-carbonyl]isoindoline-1,3-quinone Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCC(C3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC[C@@H](C3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H23N3O4/c1-24-21(27)18-10-5-14(12-19(18)22(24)28)20(26)25-11-3-4-16(13-25)23-15-6-8-17(29-2)9-7-15/h5-10,12,16,23H,3-4,11,13H2,1-2H3/t16-/m0/s1