5-butyl-2-methyl-4-phenyl-1-undecyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-4-phenyl-1-undecyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-4-phenyl-1-undecyl-pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-4-phenyl-1-undecyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-4-phenyl-1-undecylpyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-4-phenyl-1-undecyl-pyrrole-3-carboxamide Formula: C27H42N2O MolecularWeight: 410.63518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(=C(C(=C1CCCC)C2=CC=CC=C2)C(=O)N)C

Isomeric SMILES

CCCCCCCCCCCN1C(=C(C(=C1CCCC)C2=CC=CC=C2)C(=O)N)C

InChI

InChI=1S/C27H42N2O/c1-4-6-8-9-10-11-12-13-17-21-29-22(3)25(27(28)30)26(24(29)20-7-5-2)23-18-15-14-16-19-23/h14-16,18-19H,4-13,17,20-21H2,1-3H3,(H2,28,30)