ethyl 2-[4-[[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]carbamoylamino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]carbamoylamino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]carbamoylamino]phenyl]acetate CAS Name: 2-[4-[[[[4-(1-cyclohexenyl)-2,5-dimethyl-3-pyrazolyl]amino]-oxomethyl]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[4-(cyclohexen-1-yl)-2,5-dimethylpyrazol-3-yl]carbamoylamino]phenyl]acetate Traditional Name: 2-[4-[[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]carbamoylamino]phenyl]acetic acid ethyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC2=C(C(=NN2C)C)C3=CCCCC3

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC2=C(C(=NN2C)C)C3=CCCCC3

InChI

InChI=1S/C22H28N4O3/c1-4-29-19(27)14-16-10-12-18(13-11-16)23-22(28)24-21-20(15(2)25-26(21)3)17-8-6-5-7-9-17/h8,10-13H,4-7,9,14H2,1-3H3,(H2,23,24,28)