(3-nitro-11-oxidanylidene-benzo[b][1]benzothiepin-9-yl)methanol

Systemtic Name: (3-nitro-11-oxidanylidene-benzo[b][1]benzothiepin-9-yl)methanol Openeye Name: (3-nitro-11-oxo-benzo[b][1]benzothiepin-9-yl)methanol CAS Name: (3-nitro-11-oxo-9-benzo[b][1]benzothiepinyl)methanol IUPAC Name: (3-nitro-11-oxobenzo[b][1]benzothiepin-9-yl)methanol Traditional Name: (11-keto-3-nitro-benzo[b][1]benzothiepin-9-yl)methanol Formula: C15H11NO4S MolecularWeight: 301.31714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC3=C(S2=O)C=CC(=C3)[N+](=O)[O-])CO

Isomeric SMILES

C1=CC(=CC2=C1C=CC3=C(S2=O)C=CC(=C3)[N+](=O)[O-])CO

InChI

InChI=1S/C15H11NO4S/c17-9-10-1-2-11-3-4-12-8-13(16(18)19)5-6-14(12)21(20)15(11)7-10/h1-8,17H,9H2