(2-phenyl-1,3-thiazol-4-yl)methyl 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O4S/c1-21(2)17-9-8-15(22(24)25)10-16(17)19(23)26-11-14-12-27-18(20-14)13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3