4-[[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]butanoate

Systemtic Name: 4-[[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]butanoate Openeye Name: 4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methylamino]butanoate CAS Name: 4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methylamino]butanoate IUPAC Name: 4-[[1-(3-chlorophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methylamino]butanoate Traditional Name: 4-[[1-(3-chlorophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methylamino]butyrate Formula: C15H15ClN3O3- MolecularWeight: 320.7509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCCCC(=O)[O-])C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=NN(C(=O)C1=CNCCCC(=O)[O-])C2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H16ClN3O3/c1-10-13(9-17-7-3-6-14(20)21)15(22)19(18-10)12-5-2-4-11(16)8-12/h2,4-5,8-9,17H,3,6-7H2,1H3,(H,20,21)/p-1