methyl 6-azido-4-methyl-5-oxidanyl-3-oxidanylidene-5-phenyl-heptanoate

Systemtic Name: methyl 6-azido-4-methyl-5-oxidanyl-3-oxidanylidene-5-phenyl-heptanoate Openeye Name: methyl 6-azido-5-hydroxy-4-methyl-3-oxo-5-phenyl-heptanoate CAS Name: 6-azido-5-hydroxy-4-methyl-3-oxo-5-phenylheptanoic acid methyl ester IUPAC Name: methyl 6-azido-5-hydroxy-4-methyl-3-oxo-5-phenylheptanoate Traditional Name: 6-azido-5-hydroxy-3-keto-4-methyl-5-phenyl-enanthic acid methyl ester Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CC(=O)OC)C(C1=CC=CC=C1)(C(C)N=[N+]=[N-])O

Isomeric SMILES

CC(C(=O)CC(=O)OC)C(C1=CC=CC=C1)(C(C)N=[N+]=[N-])O

InChI

InChI=1S/C15H19N3O4/c1-10(13(19)9-14(20)22-3)15(21,11(2)17-18-16)12-7-5-4-6-8-12/h4-8,10-11,21H,9H2,1-3H3