3-pyridin-3-ylpropyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: 3-pyridin-3-ylpropyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: 3-(3-pyridyl)propyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid 3-(3-pyridinyl)propyl ester IUPAC Name: 3-pyridin-3-ylpropyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid 3-(3-pyridyl)propyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CN=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CN=CC=C3

InChI

InChI=1S/C20H24N2O4S/c23-20(26-15-5-7-17-6-4-12-21-16-17)18-8-10-19(11-9-18)27(24,25)22-13-2-1-3-14-22/h4,6,8-12,16H,1-3,5,7,13-15H2