3-methyl-8-oxidanyl-6-phenylmethoxy-5-(phenylmethyl)-2H-isoquinolin-1-one

Systemtic Name: 3-methyl-8-oxidanyl-6-phenylmethoxy-5-(phenylmethyl)-2H-isoquinolin-1-one Openeye Name: 5-benzyl-6-benzyloxy-8-hydroxy-3-methyl-2H-isoquinolin-1-one CAS Name: 8-hydroxy-3-methyl-6-phenylmethoxy-5-(phenylmethyl)-2H-isoquinolin-1-one IUPAC Name: 5-benzyl-8-hydroxy-3-methyl-6-phenylmethoxy-2H-isoquinolin-1-one Traditional Name: 6-benzoxy-5-benzyl-8-hydroxy-3-methyl-isocarbostyril Formula: C24H21NO3 MolecularWeight: 371.42844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=C2CC3=CC=CC=C3)OCC4=CC=CC=C4)O)C(=O)N1

Isomeric SMILES

CC1=CC2=C(C(=CC(=C2CC3=CC=CC=C3)OCC4=CC=CC=C4)O)C(=O)N1

InChI

InChI=1S/C24H21NO3/c1-16-12-20-19(13-17-8-4-2-5-9-17)22(14-21(26)23(20)24(27)25-16)28-15-18-10-6-3-7-11-18/h2-12,14,26H,13,15H2,1H3,(H,25,27)