7-nitro-2-phenyl-3-prop-2-enyl-1,4$l^{6}-benzoxathiine 4,4-dioxide

Systemtic Name: 7-nitro-2-phenyl-3-prop-2-enyl-1,4$l^{6}-benzoxathiine 4,4-dioxide Openeye Name: 3-allyl-7-nitro-2-phenyl-1,4$l^{6}-benzoxathiine 4,4-dioxide CAS Name: 7-nitro-2-phenyl-3-prop-2-enyl-1,4$l^{6}-benzoxathiin 4,4-dioxide IUPAC Name: 7-nitro-2-phenyl-3-prop-2-enyl-1,4$l^{6}-benzoxathiine 4,4-dioxide Traditional Name: 3-allyl-7-nitro-2-phenyl-1,4$l^{6}-benzoxathiin 4,4-dioxide Formula: C17H13NO5S MolecularWeight: 343.35382

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(OC2=C(S1(=O)=O)C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C=CCC1=C(OC2=C(S1(=O)=O)C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H13NO5S/c1-2-6-16-17(12-7-4-3-5-8-12)23-14-11-13(18(19)20)9-10-15(14)24(16,21)22/h2-5,7-11H,1,6H2