dimethyl 3-butyl-5-phenylmethoxy-benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 3-butyl-5-phenylmethoxy-benzene-1,2-dicarboxylate Openeye Name: dimethyl 5-benzyloxy-3-butyl-benzene-1,2-dicarboxylate CAS Name: 3-butyl-5-phenylmethoxybenzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-butyl-5-phenylmethoxybenzene-1,2-dicarboxylate Traditional Name: 5-benzoxy-3-butyl-benzene-1,2-dicarboxylic acid dimethyl ester Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H24O5/c1-4-5-11-16-12-17(26-14-15-9-7-6-8-10-15)13-18(20(22)24-2)19(16)21(23)25-3/h6-10,12-13H,4-5,11,14H2,1-3H3