tert-butyl 2-[8-(4-cyanophenyl)carbonyl-3-oxidanylidene-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[8-(4-cyanophenyl)carbonyl-3-oxidanylidene-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]ethanoate Openeye Name: tert-butyl 2-[8-(4-cyanobenzoyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]acetate CAS Name: 2-[8-[(4-cyanophenyl)-oxomethyl]-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[8-(4-cyanobenzoyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]acetate Traditional Name: 2-[8-(4-cyanobenzoyl)-3-keto-4-oxa-2,8-diazaspiro[4.5]decan-2-yl]acetic acid tert-butyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CC2(CCN(CC2)C(=O)C3=CC=C(C=C3)C#N)OC1=O

Isomeric SMILES

CC(C)(C)OC(=O)CN1CC2(CCN(CC2)C(=O)C3=CC=C(C=C3)C#N)OC1=O

InChI

InChI=1S/C21H25N3O5/c1-20(2,3)28-17(25)13-24-14-21(29-19(24)27)8-10-23(11-9-21)18(26)16-6-4-15(12-22)5-7-16/h4-7H,8-11,13-14H2,1-3H3