2-[(1-methyl-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenyl-but-3-enyl]benzamide

Systemtic Name: 2-[(1-methyl-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenyl-but-3-enyl]benzamide Openeye Name: 2-[(7-hydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenyl-but-3-enyl]benzamide CAS Name: 2-[(7-hydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenylbut-3-enyl]benzamide IUPAC Name: 2-[(7-hydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenylbut-3-enyl]benzamide Traditional Name: 2-[(7-hydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[(E)-3-methyl-4-phenyl-but-3-enyl]benzamide Formula: C29H32N2O2 MolecularWeight: 440.57658

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CCN1CC3=CC=CC=C3C(=O)NCCC(=CC4=CC=CC=C4)C)C=CC(=C2)O

Isomeric SMILES

CC1C2=C(CCN1CC3=CC=CC=C3C(=O)NCC/C(=C/C4=CC=CC=C4)/C)C=CC(=C2)O

InChI

InChI=1S/C29H32N2O2/c1-21(18-23-8-4-3-5-9-23)14-16-30-29(33)27-11-7-6-10-25(27)20-31-17-15-24-12-13-26(32)19-28(24)22(31)2/h3-13,18-19,22,32H,14-17,20H2,1-2H3,(H,30,33)/b21-18+