ethyl (E)-4-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]but-2-enoate

Systemtic Name: ethyl (E)-4-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]but-2-enoate Openeye Name: ethyl (E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoate CAS Name: (E)-4-oxo-4-[4-(1-pyrrolidinylsulfonyl)anilino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoate Traditional Name: (E)-4-keto-4-(4-pyrrolidinosulfonylanilino)but-2-enoic acid ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C16H20N2O5S/c1-2-23-16(20)10-9-15(19)17-13-5-7-14(8-6-13)24(21,22)18-11-3-4-12-18/h5-10H,2-4,11-12H2,1H3,(H,17,19)/b10-9+