azocan-1-yl-[3-(2-methylphenyl)-5-(1,2,3,4-tetrazol-1-yl)phenyl]methanone

Systemtic Name: azocan-1-yl-[3-(2-methylphenyl)-5-(1,2,3,4-tetrazol-1-yl)phenyl]methanone Openeye Name: azocan-1-yl-[3-(o-tolyl)-5-(tetrazol-1-yl)phenyl]methanone CAS Name: 1-azocanyl-[3-(2-methylphenyl)-5-(1-tetrazolyl)phenyl]methanone IUPAC Name: azocan-1-yl-[3-(2-methylphenyl)-5-(tetrazol-1-yl)phenyl]methanone Traditional Name: azocan-1-yl-[3-(o-tolyl)-5-(tetrazol-1-yl)phenyl]methanone Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=CC(=C2)N3C=NN=N3)C(=O)N4CCCCCCC4

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=CC(=C2)N3C=NN=N3)C(=O)N4CCCCCCC4

InChI

InChI=1S/C22H25N5O/c1-17-9-5-6-10-21(17)18-13-19(15-20(14-18)27-16-23-24-25-27)22(28)26-11-7-3-2-4-8-12-26/h5-6,9-10,13-16H,2-4,7-8,11-12H2,1H3