tert-butyl N-[1-[3-[(5-chloranylnaphthalen-1-yl)sulfonylmethyl]-4-nitro-phenyl]piperidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-[3-[(5-chloranylnaphthalen-1-yl)sulfonylmethyl]-4-nitro-phenyl]piperidin-4-yl]carbamate Openeye Name: tert-butyl N-[1-[3-[(5-chloro-1-naphthyl)sulfonylmethyl]-4-nitro-phenyl]-4-piperidyl]carbamate CAS Name: N-[1-[3-[(5-chloro-1-naphthalenyl)sulfonylmethyl]-4-nitrophenyl]-4-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[3-[(5-chloronaphthalen-1-yl)sulfonylmethyl]-4-nitrophenyl]piperidin-4-yl]carbamate Traditional Name: N-[1-[3-[(5-chloro-1-naphthyl)sulfonylmethyl]-4-nitro-phenyl]-4-piperidyl]carbamic acid tert-butyl ester Formula: C27H30ClN3O6S MolecularWeight: 560.0616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=CC4=C3C=CC=C4Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=CC4=C3C=CC=C4Cl

InChI

InChI=1S/C27H30ClN3O6S/c1-27(2,3)37-26(32)29-19-12-14-30(15-13-19)20-10-11-24(31(33)34)18(16-20)17-38(35,36)25-9-5-6-21-22(25)7-4-8-23(21)28/h4-11,16,19H,12-15,17H2,1-3H3,(H,29,32)