5-butan-2-yl-3,3-dimethyl-2-phenyl-pyrrole

Systemtic Name: 5-butan-2-yl-3,3-dimethyl-2-phenyl-pyrrole Openeye Name: 3,3-dimethyl-2-phenyl-5-sec-butyl-pyrrole CAS Name: 5-butan-2-yl-3,3-dimethyl-2-phenylpyrrole IUPAC Name: 5-butan-2-yl-3,3-dimethyl-2-phenylpyrrole Traditional Name: 3,3-dimethyl-2-phenyl-5-sec-butyl-pyrrole Formula: C16H21N MolecularWeight: 227.34464

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(C(=N1)C2=CC=CC=C2)(C)C

Isomeric SMILES

CCC(C)C1=CC(C(=N1)C2=CC=CC=C2)(C)C

InChI

InChI=1S/C16H21N/c1-5-12(2)14-11-16(3,4)15(17-14)13-9-7-6-8-10-13/h6-12H,5H2,1-4H3