N-[[4-[[2-(dimethylaminomethyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[[2-(dimethylaminomethyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[[2-(dimethylaminomethyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[2-(dimethylaminomethyl)anilino]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[[2-(dimethylaminomethyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[[2-(dimethylaminomethyl)phenyl]carbamoyl]benzyl]adamantane-1-carboxamide Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(C)CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H35N3O2/c1-31(2)18-24-5-3-4-6-25(24)30-26(32)23-9-7-19(8-10-23)17-29-27(33)28-14-20-11-21(15-28)13-22(12-20)16-28/h3-10,20-22H,11-18H2,1-2H3,(H,29,33)(H,30,32)