(E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one Openeye Name: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one CAS Name: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)-3-buten-2-one IUPAC Name: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one Traditional Name: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one Formula: C10H13NO MolecularWeight: 163.21632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C=CC(=O)C

Isomeric SMILES

CC1=CC(=C(N1)C)/C=C/C(=O)C

InChI

InChI=1S/C10H13NO/c1-7-6-10(9(3)11-7)5-4-8(2)12/h4-6,11H,1-3H3/b5-4+