ethyl 4-[(7S)-7-cyano-8-oxidanylidene-9,11-diazaspiro[5.5]undec-10-en-10-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(7S)-7-cyano-8-oxidanylidene-9,11-diazaspiro[5.5]undec-10-en-10-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(7S)-7-cyano-8-oxo-9,11-diazaspiro[5.5]undec-10-en-10-yl]piperazine-1-carboxylate CAS Name: 4-[(7S)-7-cyano-8-oxo-9,11-diazaspiro[5.5]undec-10-en-10-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(7S)-7-cyano-8-oxo-9,11-diazaspiro[5.5]undec-10-en-10-yl]piperazine-1-carboxylate Traditional Name: 4-[(7S)-7-cyano-8-keto-9,11-diazaspiro[5.5]undec-10-en-10-yl]piperazine-1-carboxylic acid ethyl ester Formula: C17H25N5O3 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC3(CCCCC3)C(C(=O)N2)C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC3(CCCCC3)[C@H](C(=O)N2)C#N

InChI

InChI=1S/C17H25N5O3/c1-2-25-16(24)22-10-8-21(9-11-22)15-19-14(23)13(12-18)17(20-15)6-4-3-5-7-17/h13H,2-11H2,1H3,(H,19,20,23)/t13-/m0/s1