2-[3-[(4-methylphenyl)amino]-2-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(4-methylphenyl)amino]-2-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[2-hydroxy-3-(4-methylanilino)propyl]isoindoline-1,3-dione CAS Name: 2-[2-hydroxy-3-(4-methylanilino)propyl]isoindole-1,3-dione IUPAC Name: 2-[2-hydroxy-3-(4-methylanilino)propyl]isoindole-1,3-dione Traditional Name: 2-[2-hydroxy-3-(p-toluidino)propyl]isoindoline-1,3-quinone Formula: C18H18N2O3 MolecularWeight: 310.34712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC(CN2C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NCC(CN2C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C18H18N2O3/c1-12-6-8-13(9-7-12)19-10-14(21)11-20-17(22)15-4-2-3-5-16(15)18(20)23/h2-9,14,19,21H,10-11H2,1H3