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

Systemtic Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-propan-2-yl-pyrrole-3-carboxamide Openeye Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-propan-2-yl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-propan-2-ylpyrrole-3-carboxamide Traditional Name: 5-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-2-methyl-pyrrole-3-carboxamide Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1C(C)C)C)C(=O)N)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCC1=C(C(=C(N1C(C)C)C)C(=O)N)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H28N2O3/c1-5-6-7-16-20(19(21(22)24)14(4)23(16)13(2)3)15-8-9-17-18(12-15)26-11-10-25-17/h8-9,12-13H,5-7,10-11H2,1-4H3,(H2,22,24)