ethyl 4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[(4-benzyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-benzylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-benzylpiperidino)sulfonylbenzoic acid ethyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25NO4S/c1-2-26-21(23)19-8-10-20(11-9-19)27(24,25)22-14-12-18(13-15-22)16-17-6-4-3-5-7-17/h3-11,18H,2,12-16H2,1H3