7-(2-methyl-1,3-dihydro-1,2,3,4-tetrazol-5-yl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid

Systemtic Name: 7-(2-methyl-1,3-dihydro-1,2,3,4-tetrazol-5-yl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid Openeye Name: 7-(2-methyl-1,3-dihydrotetrazol-5-yl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid CAS Name: 7-(2-methyl-1,3-dihydrotetrazol-5-yl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid IUPAC Name: 7-(2-methyl-1,3-dihydrotetrazol-5-yl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid Traditional Name: 7-(2-methyl-1,3-dihydrotetrazol-5-yl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CN1NC(=NN1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)O

Isomeric SMILES

CN1NC(=NN1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)O

InChI

InChI=1S/C13H14N4O3/c1-17-15-12(14-16-17)8-2-3-11-10(6-8)7-9(13(18)19)4-5-20-11/h2-3,6-7,16H,4-5H2,1H3,(H,14,15)(H,18,19)