4-[5-(azidomethyl)-2-propan-2-yloxy-phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[5-(azidomethyl)-2-propan-2-yloxy-phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[5-(azidomethyl)-2-isopropoxy-phenyl]-2,4-dioxo-butanoic acid CAS Name: 4-[5-(azidomethyl)-2-propan-2-yloxyphenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[5-(azidomethyl)-2-propan-2-yloxyphenyl]-2,4-dioxobutanoic acid Traditional Name: 4-[5-(azidomethyl)-2-isopropoxy-phenyl]-2,4-diketo-butyric acid Formula: C14H15N3O5 MolecularWeight: 305.286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CN=[N+]=[N-])C(=O)CC(=O)C(=O)O

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CN=[N+]=[N-])C(=O)CC(=O)C(=O)O

InChI

InChI=1S/C14H15N3O5/c1-8(2)22-13-4-3-9(7-16-17-15)5-10(13)11(18)6-12(19)14(20)21/h3-5,8H,6-7H2,1-2H3,(H,20,21)