2-[4-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[2-(3,4-diethoxyphenyl)ethylamino]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrazol-1-yl]acetic acid Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(N=C2)CC(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(N=C2)CC(=O)O)OCC

InChI

InChI=1S/C18H23N3O5/c1-3-25-15-6-5-13(9-16(15)26-4-2)7-8-19-18(24)14-10-20-21(11-14)12-17(22)23/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,19,24)(H,22,23)