4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3,5-dimethyl-benzaldehyde

Systemtic Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3,5-dimethyl-benzaldehyde Openeye Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-3,5-dimethyl-benzaldehyde CAS Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3,5-dimethylbenzaldehyde IUPAC Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3,5-dimethylbenzaldehyde Traditional Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-3,5-dimethyl-benzaldehyde Formula: C20H21NO3 MolecularWeight: 323.38564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N2CCC3=CC=CC=C3C2)C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N2CCC3=CC=CC=C3C2)C)C=O

InChI

InChI=1S/C20H21NO3/c1-14-9-16(12-22)10-15(2)20(14)24-13-19(23)21-8-7-17-5-3-4-6-18(17)11-21/h3-6,9-10,12H,7-8,11,13H2,1-2H3