2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl 4-methylbenzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl 4-methylbenzoate Openeye Name: 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-(1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl ester IUPAC Name: 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-(1,3-diketobenzo[de]isoquinolin-2-yl)ethyl ester Formula: C22H17NO4 MolecularWeight: 359.37468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C22H17NO4/c1-14-8-10-16(11-9-14)22(26)27-13-12-23-20(24)17-6-2-4-15-5-3-7-18(19(15)17)21(23)25/h2-11H,12-13H2,1H3