2-[[4-methoxy-3-(4-phenylpiperidin-1-yl)carbonyl-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-methoxy-3-(4-phenylpiperidin-1-yl)carbonyl-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-methoxy-3-(4-phenylpiperidine-1-carbonyl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-methoxy-3-[oxo-(4-phenyl-1-piperidinyl)methyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-methoxy-3-(4-phenylpiperidine-1-carbonyl)phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[4-methoxy-3-(4-phenylpiperidine-1-carbonyl)benzyl]isoindoline-1,3-quinone Formula: C28H26N2O4 MolecularWeight: 454.51704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N2O4/c1-34-25-12-11-19(18-30-27(32)22-9-5-6-10-23(22)28(30)33)17-24(25)26(31)29-15-13-21(14-16-29)20-7-3-2-4-8-20/h2-12,17,21H,13-16,18H2,1H3