(2S)-1-(benzotriazol-1-yl)-N-(benzotriazol-1-ylmethyl)-2-morpholin-4-ium-4-yl-2-phenyl-ethanimine

Systemtic Name: (2S)-1-(benzotriazol-1-yl)-N-(benzotriazol-1-ylmethyl)-2-morpholin-4-ium-4-yl-2-phenyl-ethanimine Openeye Name: (2S)-1-(benzotriazol-1-yl)-N-(benzotriazol-1-ylmethyl)-2-morpholin-4-ium-4-yl-2-phenyl-ethanimine CAS Name: (2S)-1-(1-benzotriazolyl)-N-(1-benzotriazolylmethyl)-2-(4-morpholin-4-iumyl)-2-phenylethanimine IUPAC Name: (2S)-1-(benzotriazol-1-yl)-N-(benzotriazol-1-ylmethyl)-2-morpholin-4-ium-4-yl-2-phenylethanimine Traditional Name: benzotriazol-1-ylmethyl-[(2S)-1-(benzotriazol-1-yl)-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amine Formula: C25H25N8O+ MolecularWeight: 453.519

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(C2=CC=CC=C2)C(=NCN3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1COCC[NH+]1[C@@H](C2=CC=CC=C2)C(=NCN3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C25H24N8O/c1-2-8-19(9-3-1)24(31-14-16-34-17-15-31)25(33-23-13-7-5-11-21(23)28-30-33)26-18-32-22-12-6-4-10-20(22)27-29-32/h1-13,24H,14-18H2/p+1/t24-/m0/s1