[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-(cyclopropylamino)-2-keto-ethyl]-[2-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H26N3O4+ MolecularWeight: 348.41674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C[NH+](C)CC(=O)NC3CC3

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)C[NH+](C)CC(=O)NC3CC3

InChI

InChI=1S/C18H25N3O4/c1-12(13-3-6-15-16(9-13)25-8-7-24-15)19-17(22)10-21(2)11-18(23)20-14-4-5-14/h3,6,9,12,14H,4-5,7-8,10-11H2,1-2H3,(H,19,22)(H,20,23)/p+1/t12-/m1/s1