2-methyl-N-[1-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]propanamide

Systemtic Name: 2-methyl-N-[1-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]propanamide Openeye Name: N-[1-(benzyloxymethyl)-2-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-2-methyl-propanamide CAS Name: 2-methyl-N-[1-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxo-3-phenylmethoxypropan-2-yl]propanamide IUPAC Name: 2-methyl-N-[1-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxo-3-phenylmethoxypropan-2-yl]propanamide Traditional Name: N-[1-(benzoxymethyl)-2-keto-2-[6-[2-(methylcarbamoylamino)phenyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-2-methyl-propionamide Formula: C31H36N4O4 MolecularWeight: 528.64194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCC3=C(C2)C=CC(=C3)C4=CC=CC=C4NC(=O)NC

Isomeric SMILES

CC(C)C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCC3=C(C2)C=CC(=C3)C4=CC=CC=C4NC(=O)NC

InChI

InChI=1S/C31H36N4O4/c1-21(2)29(36)33-28(20-39-19-22-9-5-4-6-10-22)30(37)35-16-15-23-17-24(13-14-25(23)18-35)26-11-7-8-12-27(26)34-31(38)32-3/h4-14,17,21,28H,15-16,18-20H2,1-3H3,(H,33,36)(H2,32,34,38)