3-ethoxy-4-oxidanyl-benzaldehyde; 2-methylpropanoate

Systemtic Name: 3-ethoxy-4-oxidanyl-benzaldehyde; 2-methylpropanoate Openeye Name: 3-ethoxy-4-hydroxy-benzaldehyde; 2-methylpropanoate CAS Name: 3-ethoxy-4-hydroxybenzaldehyde; 2-methylpropanoate IUPAC Name: 3-ethoxy-4-hydroxybenzaldehyde; 2-methylpropanoate Traditional Name: 3-ethoxy-4-hydroxy-benzaldehyde isobutyrate Formula: C13H17O5- MolecularWeight: 253.27108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)O.CC(C)C(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)O.CC(C)C(=O)[O-]

InChI

InChI=1S/C9H10O3.C4H8O2/c1-2-12-9-5-7(6-10)3-4-8(9)11;1-3(2)4(5)6/h3-6,11H,2H2,1H3;3H,1-2H3,(H,5,6)/p-1