ethyl 4-(phenylmethyl)-1-thiophen-3-ylsulfonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-(phenylmethyl)-1-thiophen-3-ylsulfonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-benzyl-1-(3-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 4-(phenylmethyl)-1-(3-thiophenylsulfonyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-1-thiophen-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 4-benzyl-1-(3-thienylsulfonyl)isonipecotic acid ethyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CSC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CSC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23NO4S2/c1-2-24-18(21)19(14-16-6-4-3-5-7-16)9-11-20(12-10-19)26(22,23)17-8-13-25-15-17/h3-8,13,15H,2,9-12,14H2,1H3