methyl 3-[(3-oxidanylidene-2-phenyl-1-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)carbonyl]benzoate

Systemtic Name: methyl 3-[(3-oxidanylidene-2-phenyl-1-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)carbonyl]benzoate Openeye Name: methyl 3-[3-oxo-2-phenyl-1-(2-pyridyl)-2,7-diazaspiro[3.5]nonane-7-carbonyl]benzoate CAS Name: 3-[oxo-[3-oxo-2-phenyl-1-(2-pyridinyl)-2,7-diazaspiro[3.5]nonan-7-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-oxo-2-phenyl-1-pyridin-2-yl-2,7-diazaspiro[3.5]nonane-7-carbonyl)benzoate Traditional Name: 3-[3-keto-2-phenyl-1-(2-pyridyl)-2,7-diazaspiro[3.5]nonane-7-carbonyl]benzoic acid methyl ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)N2CCC3(CC2)C(N(C3=O)C4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)N2CCC3(CC2)C(N(C3=O)C4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C27H25N3O4/c1-34-25(32)20-9-7-8-19(18-20)24(31)29-16-13-27(14-17-29)23(22-12-5-6-15-28-22)30(26(27)33)21-10-3-2-4-11-21/h2-12,15,18,23H,13-14,16-17H2,1H3