ethyl 4-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]benzoate CAS Name: 4-[[2-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]benzoic acid ethyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC2=CN(N=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC2=CN(N=C2)C

InChI

InChI=1S/C17H22N4O3/c1-4-24-17(23)14-5-7-15(8-6-14)19-16(22)12-20(2)10-13-9-18-21(3)11-13/h5-9,11H,4,10,12H2,1-3H3,(H,19,22)