4-[4-(7-methoxy-2-pyridin-3-yl-4H-1,3,4-benzotriazepin-5-yl)phenyl]morpholine

Systemtic Name: 4-[4-(7-methoxy-2-pyridin-3-yl-4H-1,3,4-benzotriazepin-5-yl)phenyl]morpholine Openeye Name: 4-[4-[7-methoxy-2-(3-pyridyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine CAS Name: 4-[4-[7-methoxy-2-(3-pyridinyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine IUPAC Name: 4-[4-(7-methoxy-2-pyridin-3-yl-4H-1,3,4-benzotriazepin-5-yl)phenyl]morpholine Traditional Name: 4-[4-[7-methoxy-2-(3-pyridyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]morpholine Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(NN=C(N=C2C=C1)C3=CN=CC=C3)C4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

COC1=CC2=C(NN=C(N=C2C=C1)C3=CN=CC=C3)C4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C24H23N5O2/c1-30-20-8-9-22-21(15-20)23(27-28-24(26-22)18-3-2-10-25-16-18)17-4-6-19(7-5-17)29-11-13-31-14-12-29/h2-10,15-16,27H,11-14H2,1H3