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

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO

InChI

InChI=1S/C19H17N3O5S/c23-9-8-20-17-7-6-15(22(25)26)10-16(17)19(24)27-11-14-12-28-18(21-14)13-4-2-1-3-5-13/h1-7,10,12,20,23H,8-9,11H2