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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCC(O1)COC(=O)NC2=CC=CC=C2)CC=CCCCC(=O)OC

Isomeric SMILES

CC1(OCCC(O1)COC(=O)NC2=CC=CC=C2)C/C=C/CCCC(=O)OC

InChI

InChI=1S/C21H29NO6/c1-21(14-9-4-3-8-12-19(23)25-2)27-15-13-18(28-21)16-26-20(24)22-17-10-6-5-7-11-17/h4-7,9-11,18H,3,8,12-16H2,1-2H3,(H,22,24)/b9-4+