4-[4-[2-(furan-2-yl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine

Systemtic Name: 4-[4-[2-(furan-2-yl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine Openeye Name: 4-[4-[2-(2-furyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine CAS Name: 4-[4-[2-(2-furanyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine IUPAC Name: 4-[4-[2-(furan-2-yl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine Traditional Name: 4-[4-[2-(2-furyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C3=C4C=CC=CC4=NC(=NN3)C5=CC=CO5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C3=C4C=CC=CC4=NC(=NN3)C5=CC=CO5

InChI

InChI=1S/C22H20N4O2/c1-2-5-19-18(4-1)21(24-25-22(23-19)20-6-3-13-28-20)16-7-9-17(10-8-16)26-11-14-27-15-12-26/h1-10,13,24H,11-12,14-15H2