butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-hexan-2-yl]azanium

Systemtic Name: butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-hexan-2-yl]azanium Openeye Name: butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)pentyl]ammonium CAS Name: butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxohexan-2-yl]ammonium IUPAC Name: butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxohexan-2-yl]azanium Traditional Name: butyl-[1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)pentyl]ammonium Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH2+]CCCC

Isomeric SMILES

CCCCC(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH2+]CCCC

InChI

InChI=1S/C18H28N2O3/c1-3-5-7-15(19-10-6-4-2)18(21)20-14-8-9-16-17(13-14)23-12-11-22-16/h8-9,13,15,19H,3-7,10-12H2,1-2H3,(H,20,21)/p+1