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

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-methyl-2-nitro-benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-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=CC=CC(=C1[N+](=O)[O-])C(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

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

InChI

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