3-pyridin-4-ylpropyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: 3-pyridin-4-ylpropyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: 3-(4-pyridyl)propyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid 3-(4-pyridyl)propyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CC=NC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CC=NC=C3

InChI

InChI=1S/C19H22N2O4S/c22-19(25-15-3-4-16-9-11-20-12-10-16)17-5-7-18(8-6-17)26(23,24)21-13-1-2-14-21/h5-12H,1-4,13-15H2