ethyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]but-3-enoate

Systemtic Name: ethyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]but-3-enoate Openeye Name: ethyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]but-3-enoate CAS Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-3-butenoic acid ethyl ester IUPAC Name: ethyl 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]but-3-enoate Traditional Name: 3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]but-3-enoic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C)NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CCOC(=O)CC(=C)NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C17H21N3O3/c1-5-23-15(21)11-12(2)18-16-13(3)19(4)20(17(16)22)14-9-7-6-8-10-14/h6-10,18H,2,5,11H2,1,3-4H3