buta-1,3-diene; 1-cyclohex-3-en-1-ylethanone; 2,4-dimethylpenta-1,4-dien-3-one

Systemtic Name: buta-1,3-diene; 1-cyclohex-3-en-1-ylethanone; 2,4-dimethylpenta-1,4-dien-3-one Openeye Name: buta-1,3-diene; 1-cyclohex-3-en-1-ylethanone; 2,4-dimethylpenta-1,4-dien-3-one CAS Name: buta-1,3-diene; 1-(1-cyclohex-3-enyl)ethanone; 2,4-dimethyl-3-penta-1,4-dienone IUPAC Name: buta-1,3-diene; 1-cyclohex-3-en-1-ylethanone; 2,4-dimethylpenta-1,4-dien-3-one Traditional Name: buta-1,3-diene; 1-cyclohex-3-en-1-ylethanone; 2,4-dimethylpenta-1,4-dien-3-one Formula: C19H28O2 MolecularWeight: 288.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C(=C)C.CC(=O)C1CCC=CC1.C=CC=C

Isomeric SMILES

CC(=C)C(=O)C(=C)C.CC(=O)C1CCC=CC1.C=CC=C

InChI

InChI=1S/C8H12O.C7H10O.C4H6/c1-7(9)8-5-3-2-4-6-8;1-5(2)7(8)6(3)4;1-3-4-2/h2-3,8H,4-6H2,1H3;1,3H2,2,4H3;3-4H,1-2H2