(2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C16H25N3O3+2 MolecularWeight: 307.388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCCO2)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C16H23N3O3/c1-12(19-7-5-18(2)6-8-19)16(20)17-13-3-4-14-15(11-13)22-10-9-21-14/h3-4,11-12H,5-10H2,1-2H3,(H,17,20)/p+2/t12-/m1/s1