tert-butyl 4-[8-(4-cyanophenyl)carbonyl-1,3-bis(oxidanylidene)-2,4,8-triazaspiro[4.5]decan-2-yl]butanoate

Systemtic Name: tert-butyl 4-[8-(4-cyanophenyl)carbonyl-1,3-bis(oxidanylidene)-2,4,8-triazaspiro[4.5]decan-2-yl]butanoate Openeye Name: tert-butyl 4-[8-(4-cyanobenzoyl)-1,3-dioxo-2,4,8-triazaspiro[4.5]decan-2-yl]butanoate CAS Name: 4-[8-[(4-cyanophenyl)-oxomethyl]-1,3-dioxo-2,4,8-triazaspiro[4.5]decan-2-yl]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[8-(4-cyanobenzoyl)-1,3-dioxo-2,4,8-triazaspiro[4.5]decan-2-yl]butanoate Traditional Name: 4-[8-(4-cyanobenzoyl)-1,3-diketo-2,4,8-triazaspiro[4.5]decan-2-yl]butyric acid tert-butyl ester Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCN1C(=O)C2(CCN(CC2)C(=O)C3=CC=C(C=C3)C#N)NC1=O

Isomeric SMILES

CC(C)(C)OC(=O)CCCN1C(=O)C2(CCN(CC2)C(=O)C3=CC=C(C=C3)C#N)NC1=O

InChI

InChI=1S/C23H28N4O5/c1-22(2,3)32-18(28)5-4-12-27-20(30)23(25-21(27)31)10-13-26(14-11-23)19(29)17-8-6-16(15-24)7-9-17/h6-9H,4-5,10-14H2,1-3H3,(H,25,31)