2-[5-(9H-xanthen-9-ylcarbonylamino)-1,2,3,4-tetrazol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(9H-xanthen-9-ylcarbonylamino)-1,2,3,4-tetrazol-2-yl]ethanoic acid Openeye Name: 2-[5-(9H-xanthene-9-carbonylamino)tetrazol-2-yl]acetic acid CAS Name: 2-[5-[[oxo(9H-xanthen-9-yl)methyl]amino]-2-tetrazolyl]acetic acid IUPAC Name: 2-[5-(9H-xanthene-9-carbonylamino)tetrazol-2-yl]acetic acid Traditional Name: 2-[5-(9H-xanthene-9-carbonylamino)tetrazol-2-yl]acetic acid Formula: C17H13N5O4 MolecularWeight: 351.31622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC4=NN(N=N4)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC4=NN(N=N4)CC(=O)O

InChI

InChI=1S/C17H13N5O4/c23-14(24)9-22-20-17(19-21-22)18-16(25)15-10-5-1-3-7-12(10)26-13-8-4-2-6-11(13)15/h1-8,15H,9H2,(H,23,24)(H,18,20,25)