4-[3-(2,2-dipyridin-3-ylethyl)pyridin-2-yl]-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-[3-(2,2-dipyridin-3-ylethyl)pyridin-2-yl]-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-[3-[2,2-bis(3-pyridyl)ethyl]-2-pyridyl]-2,3-dihydro-1,4-benzoxazine CAS Name: 4-[3-[2,2-bis(3-pyridinyl)ethyl]-2-pyridinyl]-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-[3-(2,2-dipyridin-3-ylethyl)pyridin-2-yl]-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-[3-[2,2-bis(3-pyridyl)ethyl]-2-pyridyl]-2,3-dihydro-1,4-benzoxazine Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N1C3=C(C=CC=N3)CC(C4=CN=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1COC2=CC=CC=C2N1C3=C(C=CC=N3)CC(C4=CN=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C25H22N4O/c1-2-10-24-23(9-1)29(14-15-30-24)25-19(6-5-13-28-25)16-22(20-7-3-11-26-17-20)21-8-4-12-27-18-21/h1-13,17-18,22H,14-16H2