5-(1-butyl-3-methyl-6-phenyl-cyclohexa-2,4-dien-1-yl)-2H-1,2,3,4-tetrazole

Systemtic Name: 5-(1-butyl-3-methyl-6-phenyl-cyclohexa-2,4-dien-1-yl)-2H-1,2,3,4-tetrazole Openeye Name: 5-(1-butyl-3-methyl-6-phenyl-cyclohexa-2,4-dien-1-yl)-2H-tetrazole CAS Name: 5-(1-butyl-3-methyl-6-phenyl-1-cyclohexa-2,4-dienyl)-2H-tetrazole IUPAC Name: 5-(1-butyl-3-methyl-6-phenylcyclohexa-2,4-dien-1-yl)-2H-tetrazole Traditional Name: 5-(1-butyl-3-methyl-6-phenyl-cyclohexa-2,4-dien-1-yl)-2H-tetrazole Formula: C18H22N4 MolecularWeight: 294.39408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C=C(C=CC1C2=CC=CC=C2)C)C3=NNN=N3

Isomeric SMILES

CCCCC1(C=C(C=CC1C2=CC=CC=C2)C)C3=NNN=N3

InChI

InChI=1S/C18H22N4/c1-3-4-12-18(17-19-21-22-20-17)13-14(2)10-11-16(18)15-8-6-5-7-9-15/h5-11,13,16H,3-4,12H2,1-2H3,(H,19,20,21,22)