5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)-1,2,3-triazole-4-carboxylate Openeye Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)triazole-4-carboxylate CAS Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)-4-triazolecarboxylate IUPAC Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)triazole-4-carboxylate Traditional Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-1-(3-methoxyphenyl)triazole-4-carboxylate Formula: C18H14N3O5- MolecularWeight: 352.32086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=C(N=N2)C(=O)[O-])C3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=C(N=N2)C(=O)[O-])[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H15N3O5/c1-24-12-6-4-5-11(9-12)21-17(16(18(22)23)19-20-21)15-10-25-13-7-2-3-8-14(13)26-15/h2-9,15H,10H2,1H3,(H,22,23)/p-1/t15-/m1/s1