[4-[3-(4-dimethylaminophenyl)prop-2-enoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-[3-(4-dimethylaminophenyl)prop-2-enoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-[3-(4-dimethylaminophenyl)prop-2-enoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[3-(4-dimethylaminophenyl)-1-oxoprop-2-enyl]amino]-1-pyrazolyl]methyl ester IUPAC Name: [4-[3-(4-dimethylaminophenyl)prop-2-enoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[[3-(4-dimethylaminophenyl)acryloyl]amino]pyrazol-1-yl]methyl ester Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)C=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)C=CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H26N4O3/c1-20(2,3)19(26)27-14-24-13-16(12-21-24)22-18(25)11-8-15-6-9-17(10-7-15)23(4)5/h6-13H,14H2,1-5H3,(H,22,25)