3-cyano-1-(3-methylphenyl)-N-pentyl-pyrrole-2-carboxamide

Systemtic Name: 3-cyano-1-(3-methylphenyl)-N-pentyl-pyrrole-2-carboxamide Openeye Name: 3-cyano-1-(m-tolyl)-N-pentyl-pyrrole-2-carboxamide CAS Name: 3-cyano-1-(3-methylphenyl)-N-pentyl-2-pyrrolecarboxamide IUPAC Name: 3-cyano-1-(3-methylphenyl)-N-pentylpyrrole-2-carboxamide Traditional Name: N-amyl-3-cyano-1-(m-tolyl)pyrrole-2-carboxamide Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=C(C=CN1C2=CC=CC(=C2)C)C#N

Isomeric SMILES

CCCCCNC(=O)C1=C(C=CN1C2=CC=CC(=C2)C)C#N

InChI

InChI=1S/C18H21N3O/c1-3-4-5-10-20-18(22)17-15(13-19)9-11-21(17)16-8-6-7-14(2)12-16/h6-9,11-12H,3-5,10H2,1-2H3,(H,20,22)