N,N-diethyl-2-(4-nitrophenyl)benzo[e][1,3]benzoxazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-(4-nitrophenyl)benzo[e][1,3]benzoxazole-5-sulfonamide Openeye Name: N,N-diethyl-2-(4-nitrophenyl)benzo[e][1,3]benzoxazole-5-sulfonamide CAS Name: N,N-diethyl-2-(4-nitrophenyl)-5-benzo[e][1,3]benzoxazolesulfonamide IUPAC Name: N,N-diethyl-2-(4-nitrophenyl)benzo[e][1,3]benzoxazole-5-sulfonamide Traditional Name: N,N-diethyl-2-(4-nitrophenyl)benzo[e][1,3]benzoxazole-5-sulfonamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C3=CC=CC=C31)N=C(O2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C3=CC=CC=C31)N=C(O2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5S/c1-3-23(4-2)30(27,28)19-13-18-20(17-8-6-5-7-16(17)19)22-21(29-18)14-9-11-15(12-10-14)24(25)26/h5-13H,3-4H2,1-2H3