N-[1-(6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-4-yl)butan-2-yl]-4-phenyl-benzamide

Systemtic Name: N-[1-(6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-4-yl)butan-2-yl]-4-phenyl-benzamide Openeye Name: N-[1-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-4-yl)methyl]propyl]-4-phenyl-benzamide CAS Name: N-[1-(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-4-yl)butan-2-yl]-4-phenylbenzamide IUPAC Name: N-[1-(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-4-yl)butan-2-yl]-4-phenylbenzamide Traditional Name: N-[1-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-4-yl)methyl]propyl]-4-phenyl-benzamide Formula: C26H28N2O2 MolecularWeight: 400.51272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1CNCC2=C1C=C(C=C2)O)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(CC1CNCC2=C1C=C(C=C2)O)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O2/c1-2-23(14-22-17-27-16-21-12-13-24(29)15-25(21)22)28-26(30)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,15,22-23,27,29H,2,14,16-17H2,1H3,(H,28,30)