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

Systemtic Name: 4-phenyl-N-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]butanimidate Openeye Name: 4-phenyl-N-[3-(2H-tetrazol-5-yl)phenyl]butanimidate CAS Name: 4-phenyl-N-[3-(2H-tetrazol-5-yl)phenyl]butanimidate IUPAC Name: 4-phenyl-N-[3-(2H-tetrazol-5-yl)phenyl]butanimidate Traditional Name: 4-phenyl-N-[3-(2H-tetrazol-5-yl)phenyl]butyrimidate Formula: C17H16N5O- MolecularWeight: 306.34184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O/c23-16(11-4-8-13-6-2-1-3-7-13)18-15-10-5-9-14(12-15)17-19-21-22-20-17/h1-3,5-7,9-10,12H,4,8,11H2,(H,18,23)(H,19,20,21,22)/p-1