5-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-2-(2-methylphenyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-2-(2-methylphenyl)isoindole-1,3-dione Openeye Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-(o-tolyl)isoindoline-1,3-dione CAS Name: 5-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]-2-(2-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-(2-methylphenyl)isoindole-1,3-dione Traditional Name: 5-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-2-(o-tolyl)isoindoline-1,3-quinone Formula: C28H23N3O4 MolecularWeight: 465.49992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)C5=NC6=CC=CC=C6O5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)C5=NC6=CC=CC=C6O5

InChI

InChI=1S/C28H23N3O4/c1-17-6-2-4-8-23(17)31-27(33)20-11-10-19(16-21(20)28(31)34)26(32)30-14-12-18(13-15-30)25-29-22-7-3-5-9-24(22)35-25/h2-11,16,18H,12-15H2,1H3