ethyl 4-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-4-oxo-butanoate CAS Name: 4-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylamino]-4-oxobutanoate Traditional Name: 4-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylamino]-4-keto-butyric acid ethyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NCC1=C(N(N=C1C)CC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)CCC(=O)NCC1=C(N(N=C1C)CC2=CC=CC=C2)C

InChI

InChI=1S/C19H25N3O3/c1-4-25-19(24)11-10-18(23)20-12-17-14(2)21-22(15(17)3)13-16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3,(H,20,23)