4-[4-(2-oxidanylidenechromen-3-yl)carbonylpiperazin-1-yl]-2-(pyridin-4-ylmethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-(2-oxidanylidenechromen-3-yl)carbonylpiperazin-1-yl]-2-(pyridin-4-ylmethyl)isoindole-1,3-dione Openeye Name: 4-[4-(2-oxochromene-3-carbonyl)piperazin-1-yl]-2-(4-pyridylmethyl)isoindoline-1,3-dione CAS Name: 4-[4-[oxo-(2-oxo-1-benzopyran-3-yl)methyl]-1-piperazinyl]-2-(pyridin-4-ylmethyl)isoindole-1,3-dione IUPAC Name: 4-[4-(2-oxochromene-3-carbonyl)piperazin-1-yl]-2-(pyridin-4-ylmethyl)isoindole-1,3-dione Traditional Name: 4-[4-(2-ketochromene-3-carbonyl)piperazino]-2-(4-pyridylmethyl)isoindoline-1,3-quinone Formula: C28H22N4O5 MolecularWeight: 494.49808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC=NC=C4)C(=O)C5=CC6=CC=CC=C6OC5=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC=NC=C4)C(=O)C5=CC6=CC=CC=C6OC5=O

InChI

InChI=1S/C28H22N4O5/c33-25(21-16-19-4-1-2-7-23(19)37-28(21)36)31-14-12-30(13-15-31)22-6-3-5-20-24(22)27(35)32(26(20)34)17-18-8-10-29-11-9-18/h1-11,16H,12-15,17H2