tert-butyl N-[1-[4-azanyl-3-(naphthalen-2-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-azanyl-3-(naphthalen-2-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate Openeye Name: tert-butyl N-[1-[4-amino-3-(2-naphthylsulfonylmethyl)phenyl]-4-piperidyl]carbamate CAS Name: N-[1-[4-amino-3-(2-naphthalenylsulfonylmethyl)phenyl]-4-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-amino-3-(naphthalen-2-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate Traditional Name: N-[1-[4-amino-3-(2-naphthylsulfonylmethyl)phenyl]-4-piperidyl]carbamic acid tert-butyl ester Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)N)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)N)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H33N3O4S/c1-27(2,3)34-26(31)29-22-12-14-30(15-13-22)23-9-11-25(28)21(16-23)18-35(32,33)24-10-8-19-6-4-5-7-20(19)17-24/h4-11,16-17,22H,12-15,18,28H2,1-3H3,(H,29,31)