methyl 2-[[(1E)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]ethyl]amino]benzoate

Systemtic Name: methyl 2-[[(1E)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]ethyl]amino]benzoate Openeye Name: methyl 2-[[(1E)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]ethyl]amino]benzoate CAS Name: 2-[[(1E)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxo-4-pyrazolylidene]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(1E)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxopyrazol-4-ylidene]ethyl]amino]benzoate Traditional Name: 2-[[(1E)-1-[5-keto-1-(4-methoxyphenyl)-3-methyl-2-pyrazolin-4-ylidene]ethyl]amino]benzoic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NC2=CC=CC=C2C(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(\C)/NC2=CC=CC=C2C(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O4/c1-13(22-18-8-6-5-7-17(18)21(26)28-4)19-14(2)23-24(20(19)25)15-9-11-16(27-3)12-10-15/h5-12,22H,1-4H3/b19-13+