methyl 3-oxidanylidene-2-propan-2-yl-pent-4-ynoate

Systemtic Name: methyl 3-oxidanylidene-2-propan-2-yl-pent-4-ynoate Openeye Name: methyl 2-isopropyl-3-oxo-pent-4-ynoate CAS Name: 3-oxo-2-propan-2-yl-4-pentynoic acid methyl ester IUPAC Name: methyl 3-oxo-2-propan-2-ylpent-4-ynoate Traditional Name: 2-isopropyl-3-keto-pent-4-ynoic acid methyl ester Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C#C)C(=O)OC

Isomeric SMILES

CC(C)C(C(=O)C#C)C(=O)OC

InChI

InChI=1S/C9H12O3/c1-5-7(10)8(6(2)3)9(11)12-4/h1,6,8H,2-4H3