(2S,3S)-2,3-bis(benzotriazol-1-ylmethyl)-1,2,3,4-tetrahydroquinoxaline

Systemtic Name: (2S,3S)-2,3-bis(benzotriazol-1-ylmethyl)-1,2,3,4-tetrahydroquinoxaline Openeye Name: (2S,3S)-2,3-bis(benzotriazol-1-ylmethyl)-1,2,3,4-tetrahydroquinoxaline CAS Name: (2S,3S)-2,3-bis(1-benzotriazolylmethyl)-1,2,3,4-tetrahydroquinoxaline IUPAC Name: (2S,3S)-2,3-bis(benzotriazol-1-ylmethyl)-1,2,3,4-tetrahydroquinoxaline Traditional Name: (2S,3S)-2,3-bis(benzotriazol-1-ylmethyl)-1,2,3,4-tetrahydroquinoxaline Formula: C22H20N8 MolecularWeight: 396.4478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(C(N2)CN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)N[C@H]([C@@H](N2)CN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C22H20N8/c1-2-8-16-15(7-1)23-19(13-29-21-11-5-3-9-17(21)25-27-29)20(24-16)14-30-22-12-6-4-10-18(22)26-28-30/h1-12,19-20,23-24H,13-14H2/t19-,20-/m0/s1