6-bromanyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-bromanyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-bromo-N-[4-(4-methylpiperazin-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-bromo-N-[4-(4-methyl-1-piperazinyl)phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-bromo-N-[4-(4-methylpiperazin-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 6-bromo-N-[4-(4-methylpiperazino)phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C20H22BrN3O3 MolecularWeight: 432.31098

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C20H22BrN3O3/c1-23-6-8-24(9-7-23)15-4-2-14(3-5-15)22-20(25)16-12-18-19(13-17(16)21)27-11-10-26-18/h2-5,12-13H,6-11H2,1H3,(H,22,25)