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

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-methyl-3-nitro-benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C16H12N2O4S2 MolecularWeight: 360.40748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CSC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CSC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4S2/c1-10-2-3-11(6-14(10)18(20)21)16(19)22-7-13-9-24-15(17-13)12-4-5-23-8-12/h2-6,8-9H,7H2,1H3