[2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate

Systemtic Name: [2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate Openeye Name: [2-[2-(2-methoxyanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-[2-(2-methoxyanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(2-methoxyanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid [2-[2-keto-2-(o-anisidino)ethyl]thiazol-4-yl]methyl ester Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H19N3O6S/c1-13-6-5-7-15(20(13)24(27)28)21(26)30-11-14-12-31-19(22-14)10-18(25)23-16-8-3-4-9-17(16)29-2/h3-9,12H,10-11H2,1-2H3,(H,23,25)