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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

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