5-butyl-2-methyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-pyrrole-3-carboxamide Openeye Name: 1-allyl-5-butyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-4-(3-phenoxyphenyl)-1-prop-2-enylpyrrole-3-carboxamide Traditional Name: 1-allyl-5-butyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O2/c1-4-6-15-22-24(23(25(26)28)18(3)27(22)16-5-2)19-11-10-14-21(17-19)29-20-12-8-7-9-13-20/h5,7-14,17H,2,4,6,15-16H2,1,3H3,(H2,26,28)