N-[(1R)-1-(hydroxymethyl)-8-methoxy-3-oxidanylidene-2-(phenylmethyl)-1,4-dihydroisoquinolin-7-yl]ethanamide

Systemtic Name: N-[(1R)-1-(hydroxymethyl)-8-methoxy-3-oxidanylidene-2-(phenylmethyl)-1,4-dihydroisoquinolin-7-yl]ethanamide Openeye Name: N-[(1R)-2-benzyl-1-(hydroxymethyl)-8-methoxy-3-oxo-1,4-dihydroisoquinolin-7-yl]acetamide CAS Name: N-[(1R)-1-(hydroxymethyl)-8-methoxy-3-oxo-2-(phenylmethyl)-1,4-dihydroisoquinolin-7-yl]acetamide IUPAC Name: N-[(1R)-2-benzyl-1-(hydroxymethyl)-8-methoxy-3-oxo-1,4-dihydroisoquinolin-7-yl]acetamide Traditional Name: N-[(1R)-2-benzyl-3-keto-8-methoxy-1-methylol-1,4-dihydroisoquinolin-7-yl]acetamide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(CC(=O)N(C2CO)CC3=CC=CC=C3)C=C1)OC

Isomeric SMILES

CC(=O)NC1=C(C2=C(CC(=O)N([C@H]2CO)CC3=CC=CC=C3)C=C1)OC

InChI

InChI=1S/C20H22N2O4/c1-13(24)21-16-9-8-15-10-18(25)22(11-14-6-4-3-5-7-14)17(12-23)19(15)20(16)26-2/h3-9,17,23H,10-12H2,1-2H3,(H,21,24)/t17-/m0/s1