4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: 4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: 4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: 4-(tert-butyliminomethyl)-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-quinone Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)N=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)22-13-18-16-7-5-6-8-17(16)19(24)23(20(18)25)14-9-11-15(26-4)12-10-14/h5-13,18H,1-4H3