4-[(1S,3R)-1,3-bis(benzotriazol-1-yl)-3-phenyl-propyl]morpholine

Systemtic Name: 4-[(1S,3R)-1,3-bis(benzotriazol-1-yl)-3-phenyl-propyl]morpholine Openeye Name: 4-[(1S,3R)-1,3-bis(benzotriazol-1-yl)-3-phenyl-propyl]morpholine CAS Name: 4-[(1S,3R)-1,3-bis(1-benzotriazolyl)-3-phenylpropyl]morpholine IUPAC Name: 4-[(1S,3R)-1,3-bis(benzotriazol-1-yl)-3-phenylpropyl]morpholine Traditional Name: 4-[(1S,3R)-1,3-bis(benzotriazol-1-yl)-3-phenyl-propyl]morpholine Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CC(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1COCCN1[C@H](C[C@H](C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C25H25N7O/c1-2-8-19(9-3-1)24(31-22-12-6-4-10-20(22)26-28-31)18-25(30-14-16-33-17-15-30)32-23-13-7-5-11-21(23)27-29-32/h1-13,24-25H,14-18H2/t24-,25+/m1/s1