dimethyl (Z)-2-(2-pyrrolidin-1-ylphenyl)but-2-enedioate

Systemtic Name: dimethyl (Z)-2-(2-pyrrolidin-1-ylphenyl)but-2-enedioate Openeye Name: dimethyl (Z)-2-(2-pyrrolidin-1-ylphenyl)but-2-enedioate CAS Name: (Z)-2-[2-(1-pyrrolidinyl)phenyl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-(2-pyrrolidin-1-ylphenyl)but-2-enedioate Traditional Name: (Z)-2-(2-pyrrolidinophenyl)but-2-enedioic acid dimethyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C1=CC=CC=C1N2CCCC2)C(=O)OC

Isomeric SMILES

COC(=O)/C=C(/C1=CC=CC=C1N2CCCC2)\C(=O)OC

InChI

InChI=1S/C16H19NO4/c1-20-15(18)11-13(16(19)21-2)12-7-3-4-8-14(12)17-9-5-6-10-17/h3-4,7-8,11H,5-6,9-10H2,1-2H3/b13-11-