ethyl 2-[4-[(4-aminophenyl)methyl]-5-(2-ethoxy-2-oxidanylidene-ethoxy)-3-propyl-pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-aminophenyl)methyl]-5-(2-ethoxy-2-oxidanylidene-ethoxy)-3-propyl-pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(4-aminophenyl)methyl]-5-(2-ethoxy-2-oxo-ethoxy)-3-propyl-pyrazol-1-yl]acetate CAS Name: 2-[4-[(4-aminophenyl)methyl]-5-(2-ethoxy-2-oxoethoxy)-3-propyl-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-aminophenyl)methyl]-5-(2-ethoxy-2-oxoethoxy)-3-propylpyrazol-1-yl]acetate Traditional Name: 2-[4-(4-aminobenzyl)-5-(2-ethoxy-2-keto-ethoxy)-3-propyl-pyrazol-1-yl]acetic acid ethyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CC2=CC=C(C=C2)N)OCC(=O)OCC)CC(=O)OCC

Isomeric SMILES

CCCC1=NN(C(=C1CC2=CC=C(C=C2)N)OCC(=O)OCC)CC(=O)OCC

InChI

InChI=1S/C21H29N3O5/c1-4-7-18-17(12-15-8-10-16(22)11-9-15)21(29-14-20(26)28-6-3)24(23-18)13-19(25)27-5-2/h8-11H,4-7,12-14,22H2,1-3H3