ethyl (E)-4-[3,3-dimethyl-5-oxidanylidene-2-(phenylmethyl)pyrazolidin-1-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[3,3-dimethyl-5-oxidanylidene-2-(phenylmethyl)pyrazolidin-1-yl]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-(2-benzyl-3,3-dimethyl-5-oxo-pyrazolidin-1-yl)-4-oxo-but-2-enoate CAS Name: (E)-4-[3,3-dimethyl-5-oxo-2-(phenylmethyl)-1-pyrazolidinyl]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(2-benzyl-3,3-dimethyl-5-oxopyrazolidin-1-yl)-4-oxobut-2-enoate Traditional Name: (E)-4-(2-benzyl-5-keto-3,3-dimethyl-pyrazolidin-1-yl)-4-keto-but-2-enoic acid ethyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(C)C

Isomeric SMILES

CCOC(=O)/C=C/C(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(C)C

InChI

InChI=1S/C18H22N2O4/c1-4-24-17(23)11-10-15(21)20-16(22)12-18(2,3)19(20)13-14-8-6-5-7-9-14/h5-11H,4,12-13H2,1-3H3/b11-10+