3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[2-(4-tert-butylphenoxy)ethyl]propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[2-(4-tert-butylphenoxy)ethyl]propanamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C24H28N2O4/c1-24(2,3)18-8-10-19(11-9-18)30-15-13-25-21(27)12-14-26-22(28)16-17-6-4-5-7-20(17)23(26)29/h4-11H,12-16H2,1-3H3,(H,25,27)