2-(1-adamantyl)-N-[1-oxidanylidene-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[1-oxidanylidene-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-(2-benzyl-1-oxo-3,4-dihydroisoquinolin-5-yl)acetamide CAS Name: 2-(1-adamantyl)-N-[1-oxo-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]acetamide IUPAC Name: 2-(1-adamantyl)-N-(2-benzyl-1-oxo-3,4-dihydroisoquinolin-5-yl)acetamide Traditional Name: 2-(1-adamantyl)-N-(2-benzyl-1-keto-3,4-dihydroisoquinolin-5-yl)acetamide Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)CC6=CC=CC=C6

Isomeric SMILES

C1CN(C(=O)C2=C1C(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)CC6=CC=CC=C6

InChI

InChI=1S/C28H32N2O2/c31-26(17-28-14-20-11-21(15-28)13-22(12-20)16-28)29-25-8-4-7-24-23(25)9-10-30(27(24)32)18-19-5-2-1-3-6-19/h1-8,20-22H,9-18H2,(H,29,31)