N-[3-(oxolan-2-ylmethylcarbamoyl)-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[3-(oxolan-2-ylmethylcarbamoyl)-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]adamantane-1-carboxamide CAS Name: N-[3-[oxo-(2-oxolanylmethylamino)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(oxolan-2-ylmethylcarbamoyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(tetrahydrofurfurylcarbamoyl)phenyl]adamantane-1-carboxamide Formula: C35H45N3O3 MolecularWeight: 555.7501

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCC(CC6)CC7=CC=CC=C7

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCC(CC6)CC7=CC=CC=C7

InChI

InChI=1S/C35H45N3O3/c39-33(36-23-30-7-4-14-41-30)31-19-29(37-34(40)35-20-26-16-27(21-35)18-28(17-26)22-35)8-9-32(31)38-12-10-25(11-13-38)15-24-5-2-1-3-6-24/h1-3,5-6,8-9,19,25-28,30H,4,7,10-18,20-23H2,(H,36,39)(H,37,40)