(4S)-4-(2,4,5-trimethoxyphenyl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine

Systemtic Name: (4S)-4-(2,4,5-trimethoxyphenyl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine Openeye Name: (4S)-4-(2,4,5-trimethoxyphenyl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine CAS Name: (4S)-4-(2,4,5-trimethoxyphenyl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine IUPAC Name: (4S)-4-(2,4,5-trimethoxyphenyl)-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-amine Traditional Name: [(4S)-4-asaryl-4,10-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-5-ium-2-yl]amine Formula: C18H20N5O3+ MolecularWeight: 354.3831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2N=C(NC3=[N+]2C4=CC=CC=C4N3)N)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1[C@H]2N=C(NC3=[N+]2C4=CC=CC=C4N3)N)OC)OC

InChI

InChI=1S/C18H19N5O3/c1-24-13-9-15(26-3)14(25-2)8-10(13)16-21-17(19)22-18-20-11-6-4-5-7-12(11)23(16)18/h4-9,16H,1-3H3,(H3,19,20,21,22)/p+1/t16-/m0/s1