3-pyridin-4-ylpropyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: 3-pyridin-4-ylpropyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: 3-(4-pyridyl)propyl 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid 3-(4-pyridyl)propyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CC=NC=C3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC3=CC=NC=C3

InChI

InChI=1S/C21H26N2O4S/c1-17-10-14-23(15-11-17)28(25,26)20-6-4-19(5-7-20)21(24)27-16-2-3-18-8-12-22-13-9-18/h4-9,12-13,17H,2-3,10-11,14-16H2,1H3