8,9-dimethoxy-N-naphthalen-2-yl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine

Systemtic Name: 8,9-dimethoxy-N-naphthalen-2-yl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: 8,9-dimethoxy-N-(2-naphthyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: 8,9-dimethoxy-N-(2-naphthalenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine IUPAC Name: 8,9-dimethoxy-N-naphthalen-2-yl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Traditional Name: (8,9-dimethoxy-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-yl)-(2-naphthyl)amine Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CNC3=C(N=CN=C3O2)NC4=CC5=CC=CC=C5C=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CNC3=C(N=CN=C3O2)NC4=CC5=CC=CC=C5C=C4)OC

InChI

InChI=1S/C23H20N4O3/c1-28-19-10-16-12-24-21-22(25-13-26-23(21)30-18(16)11-20(19)29-2)27-17-8-7-14-5-3-4-6-15(14)9-17/h3-11,13,24H,12H2,1-2H3,(H,25,26,27)