N-[3-[(3-cyanophenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(3-cyanophenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-(3-cyanoanilino)-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-(3-cyanoanilino)-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-(3-cyanoanilino)-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-(3-cyanoanilino)-3-keto-propyl]adamantane-1-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H25N3O2/c22-13-14-2-1-3-18(9-14)24-19(25)4-5-23-20(26)21-10-15-6-16(11-21)8-17(7-15)12-21/h1-3,9,15-17H,4-8,10-12H2,(H,23,26)(H,24,25)