[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[6,8-bis(oxidanylidene)-7,9-diazaspiro[4.4]nonan-7-yl]propanoate

Systemtic Name: [(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[6,8-bis(oxidanylidene)-7,9-diazaspiro[4.4]nonan-7-yl]propanoate Openeye Name: [(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl] 3-(6,8-dioxo-7,9-diazaspiro[4.4]nonan-7-yl)propanoate CAS Name: 3-(6,8-dioxo-7,9-diazaspiro[4.4]nonan-7-yl)propanoic acid [(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] 3-(6,8-dioxo-7,9-diazaspiro[4.4]nonan-7-yl)propanoate Traditional Name: 3-(6,8-diketo-7,9-diazaspiro[4.4]nonan-7-yl)propionic acid [(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCN2C(=O)C3(CCCC3)NC2=O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)OC(=O)CCN2C(=O)C3(CCCC3)NC2=O

InChI

InChI=1S/C21H27N3O5/c1-3-15-6-8-16(9-7-15)22-18(26)14(2)29-17(25)10-13-24-19(27)21(23-20(24)28)11-4-5-12-21/h6-9,14H,3-5,10-13H2,1-2H3,(H,22,26)(H,23,28)/t14-/m0/s1