methyl 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propanoate

Systemtic Name: methyl 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propanoate Openeye Name: methyl 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propanoate CAS Name: 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propanoate Traditional Name: 3-(3-methyl-1,5-dihydro-2,4-benzodioxepin-3-yl)propionic acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=CC=CC=C2CO1)CCC(=O)OC

Isomeric SMILES

CC1(OCC2=CC=CC=C2CO1)CCC(=O)OC

InChI

InChI=1S/C14H18O4/c1-14(8-7-13(15)16-2)17-9-11-5-3-4-6-12(11)10-18-14/h3-6H,7-10H2,1-2H3