methyl 4-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoate

Systemtic Name: methyl 4-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoate Openeye Name: methyl 4-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoate CAS Name: 4-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoate Traditional Name: 4-[(1-keto-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzoic acid methyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC3(CC2)C(=O)NCN3C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC3(CC2)C(=O)NCN3C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3/c1-28-20(26)18-9-7-17(8-10-18)15-24-13-11-22(12-14-24)21(27)23-16-25(22)19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,23,27)