4-butyl-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 4-butyl-1-methyl-pyrrole-2-carbonitrile Openeye Name: 4-butyl-1-methyl-pyrrole-2-carbonitrile CAS Name: 4-butyl-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 4-butyl-1-methylpyrrole-2-carbonitrile Traditional Name: 4-butyl-1-methyl-pyrrole-2-carbonitrile Formula: C10H14N2 MolecularWeight: 162.23156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C(=C1)C#N)C

Isomeric SMILES

CCCCC1=CN(C(=C1)C#N)C

InChI

InChI=1S/C10H14N2/c1-3-4-5-9-6-10(7-11)12(2)8-9/h6,8H,3-5H2,1-2H3