7-nitro-9-phenylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 7-nitro-9-phenylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 7-nitro-9-phenylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 7-nitro-9-(phenylthio)-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 7-nitro-9-phenylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 7-nitro-9-(phenylthio)-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C19H12N2O4S MolecularWeight: 364.37458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC3=C(C(=C2)[N+](=O)[O-])C(=O)NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC3=C(C(=C2)[N+](=O)[O-])C(=O)NC4=CC=CC=C4O3

InChI

InChI=1S/C19H12N2O4S/c22-19-18-15(21(23)24)10-13(26-12-6-2-1-3-7-12)11-17(18)25-16-9-5-4-8-14(16)20-19/h1-11H,(H,20,22)