N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]adamantane-1-carboxamide Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H26N2O4/c28-23(26-20-5-6-21-22(10-20)31-14-30-21)18-1-3-19(4-2-18)27-24(29)25-11-15-7-16(12-25)9-17(8-15)13-25/h1-6,10,15-17H,7-9,11-14H2,(H,26,28)(H,27,29)