6-[2-methyl-4-[(E)-(phenylcarbamoylhydrazinylidene)methyl]-1,3-dioxan-5-yl]heptanoic acid

Systemtic Name: 6-[2-methyl-4-[(E)-(phenylcarbamoylhydrazinylidene)methyl]-1,3-dioxan-5-yl]heptanoic acid Openeye Name: 6-[2-methyl-4-[(E)-(phenylcarbamoylhydrazono)methyl]-1,3-dioxan-5-yl]heptanoic acid CAS Name: 6-[4-[(E)-[[anilino(oxo)methyl]hydrazinylidene]methyl]-2-methyl-1,3-dioxan-5-yl]heptanoic acid IUPAC Name: 6-[2-methyl-4-[(E)-(phenylcarbamoylhydrazinylidene)methyl]-1,3-dioxan-5-yl]heptanoic acid Traditional Name: 6-[2-methyl-4-[(E)-(phenylcarbamoylhydrazono)methyl]-1,3-dioxan-5-yl]enanthic acid Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(C(O1)C=NNC(=O)NC2=CC=CC=C2)C(C)CCCCC(=O)O

Isomeric SMILES

CC1OCC(C(O1)/C=N/NC(=O)NC2=CC=CC=C2)C(C)CCCCC(=O)O

InChI

InChI=1S/C20H29N3O5/c1-14(8-6-7-11-19(24)25)17-13-27-15(2)28-18(17)12-21-23-20(26)22-16-9-4-3-5-10-16/h3-5,9-10,12,14-15,17-18H,6-8,11,13H2,1-2H3,(H,24,25)(H2,22,23,26)/b21-12+