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

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]propanamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-ethyl-propanamide CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]propanamide IUPAC Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]propanamide Traditional Name: N-(4-benzoxybenzyl)-3-(1,3-diketo-4H-isoquinolin-2-yl)-N-ethyl-propionamide Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

CCN(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C28H28N2O4/c1-2-29(19-21-12-14-24(15-13-21)34-20-22-8-4-3-5-9-22)26(31)16-17-30-27(32)18-23-10-6-7-11-25(23)28(30)33/h3-15H,2,16-20H2,1H3