4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenyl]morpholine

Systemtic Name: 4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenyl]morpholine Openeye Name: 4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]phenyl]morpholine CAS Name: 4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenyl]morpholine IUPAC Name: 4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenyl]morpholine Traditional Name: 4-[2-nitro-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]phenyl]morpholine Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C=CC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)/C=C/C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5S/c24-22(25)14-3-4-15-18(12-14)29-19(20-15)6-2-13-1-5-16(17(11-13)23(26)27)21-7-9-28-10-8-21/h1-6,11-12H,7-10H2/b6-2+