N-(4-chlorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine

Systemtic Name: N-(4-chlorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine Openeye Name: N-(4-chlorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine CAS Name: N-(4-chlorophenyl)-4-pyrimido[4,5-b][1,4]benzoxazepinamine IUPAC Name: N-(4-chlorophenyl)pyrimido[4,5-b][1,4]benzoxazepin-4-amine Traditional Name: (4-chlorophenyl)-pyrimido[4,5-b][1,4]benzoxazepin-4-yl-amine Formula: C17H11ClN4O MolecularWeight: 322.74844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC3=C(N=CN=C3O2)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=NC3=C(N=CN=C3O2)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H11ClN4O/c18-12-5-7-13(8-6-12)22-16-15-17(21-10-20-16)23-14-4-2-1-3-11(14)9-19-15/h1-10H,(H,20,21,22)