3-pyridin-4-ylpropyl 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethanoate

Systemtic Name: 3-pyridin-4-ylpropyl 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethanoate Openeye Name: 3-(4-pyridyl)propyl 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-benzo[de]isoquinolinyl)acetic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketobenzo[de]isoquinolin-2-yl)acetic acid 3-(4-pyridyl)propyl ester Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CC(=O)OCCCC4=CC=NC=C4

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CC(=O)OCCCC4=CC=NC=C4

InChI

InChI=1S/C22H18N2O4/c25-19(28-13-3-4-15-9-11-23-12-10-15)14-24-21(26)17-7-1-5-16-6-2-8-18(20(16)17)22(24)27/h1-2,5-12H,3-4,13-14H2