2-but-3-ynoxy-5-methoxy-benzaldehyde

Systemtic Name: 2-but-3-ynoxy-5-methoxy-benzaldehyde Openeye Name: 2-but-3-ynoxy-5-methoxy-benzaldehyde CAS Name: 2-but-3-ynoxy-5-methoxybenzaldehyde IUPAC Name: 2-but-3-ynoxy-5-methoxybenzaldehyde Traditional Name: 2-but-3-ynoxy-5-methoxy-benzaldehyde Formula: C12H12O3 MolecularWeight: 204.22188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCCC#C)C=O

Isomeric SMILES

COC1=CC(=C(C=C1)OCCC#C)C=O

InChI

InChI=1S/C12H12O3/c1-3-4-7-15-12-6-5-11(14-2)8-10(12)9-13/h1,5-6,8-9H,4,7H2,2H3