N-[[4-[(4-pyrrolidin-1-ylcarbonylphenyl)methylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[(4-pyrrolidin-1-ylcarbonylphenyl)methylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[[4-(pyrrolidine-1-carbonyl)phenyl]methylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylamino]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[[4-(pyrrolidine-1-carbonyl)phenyl]methylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[[4-(pyrrolidine-1-carbonyl)benzyl]carbamoyl]benzyl]adamantane-1-carboxamide Formula: C31H37N3O3 MolecularWeight: 499.64378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H37N3O3/c35-28(32-19-21-5-9-27(10-6-21)29(36)34-11-1-2-12-34)26-7-3-22(4-8-26)20-33-30(37)31-16-23-13-24(17-31)15-25(14-23)18-31/h3-10,23-25H,1-2,11-20H2,(H,32,35)(H,33,37)