4-[2-[3-methyl-1-(morpholin-4-ylmethyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[3-methyl-1-(morpholin-4-ylmethyl)-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzoic acid Openeye Name: 4-[2-[3-methyl-1-(morpholinomethyl)-5-oxo-pyrazol-4-ylidene]hydrazino]benzoic acid CAS Name: 4-[2-[3-methyl-1-(4-morpholinylmethyl)-5-oxo-4-pyrazolylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[2-[3-methyl-1-(morpholin-4-ylmethyl)-5-oxopyrazol-4-ylidene]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[5-keto-3-methyl-1-(morpholinomethyl)-2-pyrazolin-4-ylidene]hydrazino]benzoic acid Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)C(=O)O)CN3CCOCC3

Isomeric SMILES

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)C(=O)O)CN3CCOCC3

InChI

InChI=1S/C16H19N5O4/c1-11-14(18-17-13-4-2-12(3-5-13)16(23)24)15(22)21(19-11)10-20-6-8-25-9-7-20/h2-5,17H,6-10H2,1H3,(H,23,24)