(3E)-7-cyclohexyl-5-methyl-3-(phenylmethylidene)-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-7-cyclohexyl-5-methyl-3-(phenylmethylidene)-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-3-benzylidene-7-cyclohexyl-5-methyl-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-cyclohexyl-5-methyl-3-(phenylmethylene)-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-3-benzylidene-7-cyclohexyl-5-methyl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-3-benzal-7-cyclohexyl-5-methyl-2H-1,3-benzoxazol-3-ium Formula: C21H24NO+ MolecularWeight: 306.42136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C3CCCCC3)OC[N+]2=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC\2=C(C(=C1)C3CCCCC3)OC/[N+]2=C/C4=CC=CC=C4

InChI

InChI=1S/C21H24NO/c1-16-12-19(18-10-6-3-7-11-18)21-20(13-16)22(15-23-21)14-17-8-4-2-5-9-17/h2,4-5,8-9,12-14,18H,3,6-7,10-11,15H2,1H3/q+1/b22-14-