N-[3-[[4-(cyanomethyl)phenyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[4-(cyanomethyl)phenyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[4-(cyanomethyl)anilino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[4-(cyanomethyl)anilino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[4-(cyanomethyl)anilino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[4-(cyanomethyl)anilino]-3-keto-propyl]adamantane-1-carboxamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2/c23-7-5-15-1-3-19(4-2-15)25-20(26)6-8-24-21(27)22-12-16-9-17(13-22)11-18(10-16)14-22/h1-4,16-18H,5-6,8-14H2,(H,24,27)(H,25,26)