8-bromanyl-4-piperidin-1-yl-pyrimido[4,5-b][1,4]benzoxazepine

Systemtic Name: 8-bromanyl-4-piperidin-1-yl-pyrimido[4,5-b][1,4]benzoxazepine Openeye Name: 8-bromo-4-(1-piperidyl)pyrimido[4,5-b][1,4]benzoxazepine CAS Name: 8-bromo-4-(1-piperidinyl)pyrimido[4,5-b][1,4]benzoxazepine IUPAC Name: 8-bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine Traditional Name: 8-bromo-4-piperidino-pyrimido[4,5-b][1,4]benzoxazepine Formula: C16H15BrN4O MolecularWeight: 359.2205

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C(=NC=N2)OC4=C(C=C(C=C4)Br)C=N3

Isomeric SMILES

C1CCN(CC1)C2=C3C(=NC=N2)OC4=C(C=C(C=C4)Br)C=N3

InChI

InChI=1S/C16H15BrN4O/c17-12-4-5-13-11(8-12)9-18-14-15(19-10-20-16(14)22-13)21-6-2-1-3-7-21/h4-5,8-10H,1-3,6-7H2