methyl 3-[(3-methyl-1,3-thiazol-2-ylidene)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(3-methyl-1,3-thiazol-2-ylidene)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(3-methylthiazol-2-ylidene)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(3-methyl-2-thiazolylidene)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(3-methyl-1,3-thiazol-2-ylidene)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(3-methyl-4-thiazolin-2-ylidene)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C13H11N3O5S MolecularWeight: 321.30854

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CSC1=NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN1C=CSC1=NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H11N3O5S/c1-15-3-4-22-13(15)14-11(17)8-5-9(12(18)21-2)7-10(6-8)16(19)20/h3-7H,1-2H3