methyl 2-benzamido-4-oxidanylidene-4-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]butanoate

Systemtic Name: methyl 2-benzamido-4-oxidanylidene-4-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]butanoate Openeye Name: methyl 2-benzamido-4-oxo-4-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]butanoate CAS Name: 2-benzamido-4-oxo-4-[8-(1-oxo-3-phenylprop-2-ynyl)-3,8-diazaspiro[4.5]decan-3-yl]butanoic acid methyl ester IUPAC Name: methyl 2-benzamido-4-oxo-4-[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]butanoate Traditional Name: 2-benzamido-4-keto-4-[8-(3-phenylpropioloyl)-3,8-diazaspiro[4.5]decan-3-yl]butyric acid methyl ester Formula: C29H31N3O5 MolecularWeight: 501.57354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)N1CCC2(C1)CCN(CC2)C(=O)C#CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CC(=O)N1CCC2(C1)CCN(CC2)C(=O)C#CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O5/c1-37-28(36)24(30-27(35)23-10-6-3-7-11-23)20-26(34)32-19-16-29(21-32)14-17-31(18-15-29)25(33)13-12-22-8-4-2-5-9-22/h2-11,24H,14-21H2,1H3,(H,30,35)