N-(3-cyclohexyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzoxazol-2-amine

Systemtic Name: N-(3-cyclohexyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzoxazol-2-amine Openeye Name: N-(3-cyclohexyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzoxazol-2-amine CAS Name: N-(3-cyclohexyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzoxazol-2-amine IUPAC Name: N-(3-cyclohexyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-1,3-benzoxazol-2-amine Traditional Name: 1,3-benzoxazol-2-yl-(3-cyclohexyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)amine Formula: C16H22N5O+ MolecularWeight: 300.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CNC(=NC2)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(CC1)[NH+]2CNC(=NC2)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C16H21N5O/c1-2-6-12(7-3-1)21-10-17-15(18-11-21)20-16-19-13-8-4-5-9-14(13)22-16/h4-5,8-9,12H,1-3,6-7,10-11H2,(H2,17,18,19,20)/p+1