4-[[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzamide

Systemtic Name: 4-[[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzamide Openeye Name: 4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide CAS Name: 4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide IUPAC Name: 4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide Traditional Name: 4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(C=C3)C(=O)N)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(C=C3)C(=O)N)O)O

InChI

InChI=1S/C18H20N2O3/c1-11-15-9-17(22)16(21)8-14(15)6-7-20(11)10-12-2-4-13(5-3-12)18(19)23/h2-5,8-9,11,21-22H,6-7,10H2,1H3,(H2,19,23)