N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C21H21BrN2O4/c1-2-13-3-5-15(6-4-13)24-12-14(9-20(24)25)21(26)23-17-11-19-18(10-16(17)22)27-7-8-28-19/h3-6,10-11,14H,2,7-9,12H2,1H3,(H,23,26)