2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitro-benzoate

Systemtic Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitro-benzoate Openeye Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]-6-nitro-benzoate CAS Name: 2-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-oxomethyl]-6-nitrobenzoate IUPAC Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]-6-nitrobenzoate Traditional Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]-6-nitro-benzoate Formula: C18H12N3O6S- MolecularWeight: 398.36938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H13N3O6S/c1-27-11-7-5-10(6-8-11)13-9-28-18(19-13)20-16(22)12-3-2-4-14(21(25)26)15(12)17(23)24/h2-9H,1H3,(H,23,24)(H,19,20,22)/p-1