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

Systemtic Name: N-[4-[[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenyl]acetamide CAS Name: N-[4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenyl]acetamide IUPAC Name: N-[4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenyl]acetamide Traditional Name: N-[4-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenyl]acetamide Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3/c1-12-17-10-19(24)18(23)9-15(17)7-8-21(12)11-14-3-5-16(6-4-14)20-13(2)22/h3-6,9-10,12,23-24H,7-8,11H2,1-2H3,(H,20,22)