tert-butyl 3-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]piperidine-1-carboxylate CAS Name: 3-[(4-methoxyphenyl)sulfonyl-(3-pyridinylmethyl)amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]piperidine-1-carboxylate Traditional Name: 3-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H31N3O5S/c1-23(2,3)31-22(27)25-14-6-8-19(17-25)26(16-18-7-5-13-24-15-18)32(28,29)21-11-9-20(30-4)10-12-21/h5,7,9-13,15,19H,6,8,14,16-17H2,1-4H3