5-(2-azanyl-5-methoxy-phenyl)carbonyl-2-cyclohexylcarbonyl-3,4-dihydropyrazole-3-carboxylic acid

Systemtic Name: 5-(2-azanyl-5-methoxy-phenyl)carbonyl-2-cyclohexylcarbonyl-3,4-dihydropyrazole-3-carboxylic acid Openeye Name: 5-(2-amino-5-methoxy-benzoyl)-2-(cyclohexanecarbonyl)-3,4-dihydropyrazole-3-carboxylic acid CAS Name: 5-[(2-amino-5-methoxyphenyl)-oxomethyl]-2-[cyclohexyl(oxo)methyl]-3,4-dihydropyrazole-3-carboxylic acid IUPAC Name: 5-(2-amino-5-methoxybenzoyl)-2-(cyclohexanecarbonyl)-3,4-dihydropyrazole-3-carboxylic acid Traditional Name: 5-(2-amino-5-methoxy-benzoyl)-2-(cyclohexanecarbonyl)-2-pyrazoline-3-carboxylic acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N)C(=O)C2=NN(C(C2)C(=O)O)C(=O)C3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)N)C(=O)C2=NN(C(C2)C(=O)O)C(=O)C3CCCCC3

InChI

InChI=1S/C19H23N3O5/c1-27-12-7-8-14(20)13(9-12)17(23)15-10-16(19(25)26)22(21-15)18(24)11-5-3-2-4-6-11/h7-9,11,16H,2-6,10,20H2,1H3,(H,25,26)