(8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol

Systemtic Name: (8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol Openeye Name: (8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol CAS Name: (8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol IUPAC Name: (8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol Traditional Name: (8-nitro-4aH-benzo[d][2,3]benzoxathiepin-2-yl)methanol Formula: C14H11NO4S MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C=C(C=CC3SOC=C2C(=C1)[N+](=O)[O-])CO

Isomeric SMILES

C1=CC2=C3C=C(C=CC3SOC=C2C(=C1)[N+](=O)[O-])CO

InChI

InChI=1S/C14H11NO4S/c16-7-9-4-5-14-11(6-9)10-2-1-3-13(15(17)18)12(10)8-19-20-14/h1-6,8,14,16H,7H2