1,3-benzothiazol-2-ylmethyl 1-ethanoyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 1-ethanoyl-4-phenyl-piperidine-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 1-acetyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-acetyl-4-phenyl-4-piperidinecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 1-acetyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-acetyl-4-phenyl-isonipecotic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N2O3S/c1-16(25)24-13-11-22(12-14-24,17-7-3-2-4-8-17)21(26)27-15-20-23-18-9-5-6-10-19(18)28-20/h2-10H,11-15H2,1H3