5-methyl-4-pentyl-1H-pyrrole-2-carbaldehyde

Systemtic Name: 5-methyl-4-pentyl-1H-pyrrole-2-carbaldehyde Openeye Name: 5-methyl-4-pentyl-1H-pyrrole-2-carbaldehyde CAS Name: 5-methyl-4-pentyl-1H-pyrrole-2-carboxaldehyde IUPAC Name: 5-methyl-4-pentyl-1H-pyrrole-2-carbaldehyde Traditional Name: 4-amyl-5-methyl-1H-pyrrole-2-carbaldehyde Formula: C11H17NO MolecularWeight: 179.25878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(NC(=C1)C=O)C

Isomeric SMILES

CCCCCC1=C(NC(=C1)C=O)C

InChI

InChI=1S/C11H17NO/c1-3-4-5-6-10-7-11(8-13)12-9(10)2/h7-8,12H,3-6H2,1-2H3