N-[4-(dimethylamino)-3-[(phenylmethyl)carbamoyl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(dimethylamino)-3-[(phenylmethyl)carbamoyl]phenyl]adamantane-1-carboxamide Openeye Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]adamantane-1-carboxamide CAS Name: N-[4-(dimethylamino)-3-[oxo-[(phenylmethyl)amino]methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]adamantane-1-carboxamide Traditional Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]adamantane-1-carboxamide Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C27H33N3O2/c1-30(2)24-9-8-22(13-23(24)25(31)28-17-18-6-4-3-5-7-18)29-26(32)27-14-19-10-20(15-27)12-21(11-19)16-27/h3-9,13,19-21H,10-12,14-17H2,1-2H3,(H,28,31)(H,29,32)