3,5-diacetamido-N-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzenecarboximidate

Systemtic Name: 3,5-diacetamido-N-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzenecarboximidate Openeye Name: 3,5-diacetamido-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate CAS Name: 3,5-diacetamido-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate IUPAC Name: 3,5-diacetamido-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate Traditional Name: 3,5-diacetamido-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate Formula: C18H16N7O3- MolecularWeight: 378.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=NC2=CC=CC(=C2)C3=NNN=N3)[O-])NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=NC2=CC=CC(=C2)C3=NNN=N3)[O-])NC(=O)C

InChI

InChI=1S/C18H17N7O3/c1-10(26)19-15-7-13(8-16(9-15)20-11(2)27)18(28)21-14-5-3-4-12(6-14)17-22-24-25-23-17/h3-9H,1-2H3,(H,19,26)(H,20,27)(H,21,28)(H,22,23,24,25)/p-1