N-butyl-3-cyano-1-phenyl-pyrrole-2-carboxamide

Systemtic Name: N-butyl-3-cyano-1-phenyl-pyrrole-2-carboxamide Openeye Name: N-butyl-3-cyano-1-phenyl-pyrrole-2-carboxamide CAS Name: N-butyl-3-cyano-1-phenyl-2-pyrrolecarboxamide IUPAC Name: N-butyl-3-cyano-1-phenylpyrrole-2-carboxamide Traditional Name: N-butyl-3-cyano-1-phenyl-pyrrole-2-carboxamide Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O/c1-2-3-10-18-16(20)15-13(12-17)9-11-19(15)14-7-5-4-6-8-14/h4-9,11H,2-3,10H2,1H3,(H,18,20)