3-cyano-N-(3-methylbutyl)-1-(4-phenoxyphenyl)pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-(3-methylbutyl)-1-(4-phenoxyphenyl)pyrrole-2-carboxamide Openeye Name: 3-cyano-N-isopentyl-1-(4-phenoxyphenyl)pyrrole-2-carboxamide CAS Name: 3-cyano-N-(3-methylbutyl)-1-(4-phenoxyphenyl)-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-(3-methylbutyl)-1-(4-phenoxyphenyl)pyrrole-2-carboxamide Traditional Name: 3-cyano-N-isoamyl-1-(4-phenoxyphenyl)pyrrole-2-carboxamide Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(C=CN1C2=CC=C(C=C2)OC3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)CCNC(=O)C1=C(C=CN1C2=CC=C(C=C2)OC3=CC=CC=C3)C#N

InChI

InChI=1S/C23H23N3O2/c1-17(2)12-14-25-23(27)22-18(16-24)13-15-26(22)19-8-10-21(11-9-19)28-20-6-4-3-5-7-20/h3-11,13,15,17H,12,14H2,1-2H3,(H,25,27)