4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecyl-pyrrole-3-carboxamide

Systemtic Name: 4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecyl-pyrrole-3-carboxamide Openeye Name: 4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecyl-pyrrole-3-carboxamide CAS Name: 4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecylpyrrole-3-carboxamide Traditional Name: 4-(4-cyanophenyl)-2-methyl-5-propyl-1-undecyl-pyrrole-3-carboxamide Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(=C(C(=C1CCC)C2=CC=C(C=C2)C#N)C(=O)N)C

Isomeric SMILES

CCCCCCCCCCCN1C(=C(C(=C1CCC)C2=CC=C(C=C2)C#N)C(=O)N)C

InChI

InChI=1S/C27H39N3O/c1-4-6-7-8-9-10-11-12-13-19-30-21(3)25(27(29)31)26(24(30)14-5-2)23-17-15-22(20-28)16-18-23/h15-18H,4-14,19H2,1-3H3,(H2,29,31)