ethyl 3-cyclopentyl-2-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: ethyl 3-cyclopentyl-2-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: ethyl 3-cyclopentyl-2-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-cyclopentyl-2-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-cyclopentyl-2-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-cyclopentyl-2-(4-piperidinosulfonylphenyl)propionic acid ethyl ester Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1CCCC1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C(CC1CCCC1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H31NO4S/c1-2-26-21(23)20(16-17-8-4-5-9-17)18-10-12-19(13-11-18)27(24,25)22-14-6-3-7-15-22/h10-13,17,20H,2-9,14-16H2,1H3