1-[3-[2-(4-methoxyphenyl)ethylamino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-[2-(4-methoxyphenyl)ethylamino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-[2-(4-methoxyphenyl)ethylamino]-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-[2-(4-methoxyphenyl)ethylamino]-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-[2-(4-methoxyphenyl)ethylamino]-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-keto-3-[2-(4-methoxyphenyl)ethylamino]propyl]pyrazole-4-carboxylic acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CCN2C=C(C=N2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CCN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C16H19N3O4/c1-23-14-4-2-12(3-5-14)6-8-17-15(20)7-9-19-11-13(10-18-19)16(21)22/h2-5,10-11H,6-9H2,1H3,(H,17,20)(H,21,22)