(2S)-2-ethanoyl-1-[(3-oxidanyl-1-adamantyl)amino]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-2-ethanoyl-1-[(3-oxidanyl-1-adamantyl)amino]pyrrolidine-2-carbonitrile Openeye Name: (2S)-2-acetyl-1-[(3-hydroxy-1-adamantyl)amino]pyrrolidine-2-carbonitrile CAS Name: (2S)-2-acetyl-1-[(3-hydroxy-1-adamantyl)amino]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-2-acetyl-1-[(3-hydroxy-1-adamantyl)amino]pyrrolidine-2-carbonitrile Traditional Name: (2S)-2-acetyl-1-[(3-hydroxy-1-adamantyl)amino]pyrrolidine-2-carbonitrile Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCCN1NC23CC4CC(C2)CC(C4)(C3)O)C#N

Isomeric SMILES

CC(=O)[C@]1(CCCN1NC23CC4CC(C2)CC(C4)(C3)O)C#N

InChI

InChI=1S/C17H25N3O2/c1-12(21)17(11-18)3-2-4-20(17)19-15-6-13-5-14(7-15)9-16(22,8-13)10-15/h13-14,19,22H,2-10H2,1H3/t13?,14?,15?,16?,17-/m0/s1