[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[(2R)-1-methoxypropan-2-yl]azanium

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[(2R)-1-methoxypropan-2-yl]azanium Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxycarbonyl-pyrazol-3-yl]methyl-[(1R)-2-methoxy-1-methyl-ethyl]ammonium CAS Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxycarbonyl-3-pyrazolyl]methyl-[(2R)-1-methoxypropan-2-yl]ammonium IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxycarbonylpyrazol-3-yl]methyl-[(2R)-1-methoxypropan-2-yl]azanium Traditional Name: [4-carbethoxy-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazol-3-yl]methyl-[(1R)-2-methoxy-1-methyl-ethyl]ammonium Formula: C19H26N3O5+ MolecularWeight: 376.42684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC3=C(C=C2)OCCO3)C[NH2+]C(C)COC

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC3=C(C=C2)OCCO3)C[NH2+][C@H](C)COC

InChI

InChI=1S/C19H25N3O5/c1-4-25-19(23)15-10-21-22(16(15)11-20-13(2)12-24-3)14-5-6-17-18(9-14)27-8-7-26-17/h5-6,9-10,13,20H,4,7-8,11-12H2,1-3H3/p+1/t13-/m1/s1