N-[4-(4-methoxyphenyl)butyl]-2-[(6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide

Systemtic Name: N-[4-(4-methoxyphenyl)butyl]-2-[(6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]benzamide Openeye Name: 2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[4-(4-methoxyphenyl)butyl]benzamide CAS Name: 2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[4-(4-methoxyphenyl)butyl]benzamide IUPAC Name: 2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[4-(4-methoxyphenyl)butyl]benzamide Traditional Name: 2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-[4-(4-methoxyphenyl)butyl]benzamide Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCNC(=O)C2=CC=CC=C2CN3CCC4=C(C3)C=CC(=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCCNC(=O)C2=CC=CC=C2CN3CCC4=C(C3)C=CC(=C4)O

InChI

InChI=1S/C28H32N2O3/c1-33-26-13-9-21(10-14-26)6-4-5-16-29-28(32)27-8-3-2-7-24(27)20-30-17-15-22-18-25(31)12-11-23(22)19-30/h2-3,7-14,18,31H,4-6,15-17,19-20H2,1H3,(H,29,32)