(E)-7-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-1-quinoxalin-2-yl-hept-1-en-3-ol

Systemtic Name: (E)-7-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-1-quinoxalin-2-yl-hept-1-en-3-ol Openeye Name: (E)-7-[6-[(4-methoxyphenyl)methylamino]-2-pyridyl]-1-quinoxalin-2-yl-hept-1-en-3-ol CAS Name: (E)-7-[6-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-1-(2-quinoxalinyl)-1-hepten-3-ol IUPAC Name: (E)-7-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-1-quinoxalin-2-ylhept-1-en-3-ol Traditional Name: (E)-7-[6-(p-anisylamino)-2-pyridyl]-1-quinoxalin-2-yl-hept-1-en-3-ol Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=CC=CC(=N2)CCCCC(C=CC3=NC4=CC=CC=C4N=C3)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=CC=CC(=N2)CCCCC(/C=C/C3=NC4=CC=CC=C4N=C3)O

InChI

InChI=1S/C28H30N4O2/c1-34-25-17-13-21(14-18-25)19-30-28-12-6-8-22(32-28)7-2-3-9-24(33)16-15-23-20-29-26-10-4-5-11-27(26)31-23/h4-6,8,10-18,20,24,33H,2-3,7,9,19H2,1H3,(H,30,32)/b16-15+