tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[(3-nitrophenyl)methyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[(3-nitrophenyl)methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[(3-nitrophenyl)methyl]amino]piperidine-1-carboxylate CAS Name: 3-[(4-methoxyphenyl)sulfonyl-[(3-nitrophenyl)methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[(3-nitrophenyl)methyl]amino]piperidine-1-carboxylate Traditional Name: 3-[(4-methoxyphenyl)sulfonyl-(3-nitrobenzyl)amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H31N3O7S MolecularWeight: 505.58384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31N3O7S/c1-24(2,3)34-23(28)25-14-6-9-20(17-25)26(16-18-7-5-8-19(15-18)27(29)30)35(31,32)22-12-10-21(33-4)11-13-22/h5,7-8,10-13,15,20H,6,9,14,16-17H2,1-4H3