N-[4-(4-methylpiperidin-1-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-methyl-1-piperidyl)-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-(4-methyl-1-piperidinyl)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-methylpiperidino)-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Formula: C28H39N3O2 MolecularWeight: 449.62816

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)N6CCCC6

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)N6CCCC6

InChI

InChI=1S/C28H39N3O2/c1-19-6-10-30(11-7-19)25-5-4-23(15-24(25)26(32)31-8-2-3-9-31)29-27(33)28-16-20-12-21(17-28)14-22(13-20)18-28/h4-5,15,19-22H,2-3,6-14,16-18H2,1H3,(H,29,33)