4-[5,5-bis(azanyl)-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde

Systemtic Name: 4-[5,5-bis(azanyl)-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde Openeye Name: 4-[5,5-diamino-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde CAS Name: 4-[5,5-diamino-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde IUPAC Name: 4-[5,5-diamino-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde Traditional Name: 4-[5,5-diamino-3-(4-nitrophenyl)-1,4,2-oxathiazolidin-2-yl]benzaldehyde Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=O)N2C(SC(O2)(N)N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=O)N2C(SC(O2)(N)N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O4S/c16-15(17)23-18(12-5-1-10(9-20)2-6-12)14(24-15)11-3-7-13(8-4-11)19(21)22/h1-9,14H,16-17H2