N-[3-(4-methylpiperidin-1-yl)carbonyl-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[3-(4-methylpiperidin-1-yl)carbonyl-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(4-methylpiperidine-1-carbonyl)phenyl]adamantane-1-carboxamide CAS Name: N-[3-[(4-methyl-1-piperidinyl)-oxomethyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(4-methylpiperidine-1-carbonyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(4-methylpiperidine-1-carbonyl)phenyl]adamantane-1-carboxamide Formula: C36H47N3O2 MolecularWeight: 553.77728

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCC(CC6)CC7=CC=CC=C7

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)N6CCC(CC6)CC7=CC=CC=C7

InChI

InChI=1S/C36H47N3O2/c1-25-9-13-39(14-10-25)34(40)32-21-31(37-35(41)36-22-28-18-29(23-36)20-30(19-28)24-36)7-8-33(32)38-15-11-27(12-16-38)17-26-5-3-2-4-6-26/h2-8,21,25,27-30H,9-20,22-24H2,1H3,(H,37,41)