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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C(C)CCC(C)C)C2=CC3=C(C=C2)OCCO3)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1C(C)CCC(C)C)C2=CC3=C(C=C2)OCCO3)C(=O)N

InChI

InChI=1S/C21H28N2O3/c1-13(2)5-6-14(3)23-15(4)17(21(22)24)12-18(23)16-7-8-19-20(11-16)26-10-9-25-19/h7-8,11-14H,5-6,9-10H2,1-4H3,(H2,22,24)