methyl (E)-7-[2-methyl-4-(phenylcarbamoyloxymethyl)-1,3-dioxan-5-yl]hept-5-enoate

Systemtic Name: methyl (E)-7-[2-methyl-4-(phenylcarbamoyloxymethyl)-1,3-dioxan-5-yl]hept-5-enoate Openeye Name: methyl (E)-7-[2-methyl-4-(phenylcarbamoyloxymethyl)-1,3-dioxan-5-yl]hept-5-enoate CAS Name: (E)-7-[4-[[anilino(oxo)methoxy]methyl]-2-methyl-1,3-dioxan-5-yl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[2-methyl-4-(phenylcarbamoyloxymethyl)-1,3-dioxan-5-yl]hept-5-enoate Traditional Name: (E)-7-[2-methyl-4-(phenylcarbamoyloxymethyl)-1,3-dioxan-5-yl]hept-5-enoic acid methyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(C(O1)COC(=O)NC2=CC=CC=C2)CC=CCCCC(=O)OC

Isomeric SMILES

CC1OCC(C(O1)COC(=O)NC2=CC=CC=C2)C/C=C/CCCC(=O)OC

InChI

InChI=1S/C21H29NO6/c1-16-26-14-17(10-6-3-4-9-13-20(23)25-2)19(28-16)15-27-21(24)22-18-11-7-5-8-12-18/h3,5-8,11-12,16-17,19H,4,9-10,13-15H2,1-2H3,(H,22,24)/b6-3+