5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-(phenylmethyl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpyrrole-3-carboxamide Traditional Name: 1-benzyl-5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-pyrrole-3-carboxamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)N)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)N)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C25H28N2O3/c1-3-4-10-20-24(19-11-12-21-22(15-19)30-14-13-29-21)23(25(26)28)17(2)27(20)16-18-8-6-5-7-9-18/h5-9,11-12,15H,3-4,10,13-14,16H2,1-2H3,(H2,26,28)