N-(phenylmethyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine

Systemtic Name: N-(phenylmethyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: N-benzyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: N-(phenylmethyl)-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine IUPAC Name: N-benzyl-5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-amine Traditional Name: benzyl(5,6-dihydropyrimido[4,5-b][1,4]benzoxazepin-4-yl)amine Formula: C18H16N4O MolecularWeight: 304.34584

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=NC=NC(=C3N1)NCC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2OC3=NC=NC(=C3N1)NCC4=CC=CC=C4

InChI

InChI=1S/C18H16N4O/c1-2-6-13(7-3-1)10-20-17-16-18(22-12-21-17)23-15-9-5-4-8-14(15)11-19-16/h1-9,12,19H,10-11H2,(H,20,21,22)