(2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (2-phenylthiazol-4-yl)methyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O5S/c24-18(10-11-21-19(25)14-6-8-17(9-7-14)23(26)27)28-12-16-13-29-20(22-16)15-4-2-1-3-5-15/h1-9,13H,10-12H2,(H,21,25)