(3S,5S)-3,5-dimethyl-1-(4-pentoxynaphthalen-1-yl)sulfonyl-piperidine

Systemtic Name: (3S,5S)-3,5-dimethyl-1-(4-pentoxynaphthalen-1-yl)sulfonyl-piperidine Openeye Name: (3S,5S)-3,5-dimethyl-1-[(4-pentoxy-1-naphthyl)sulfonyl]piperidine CAS Name: (3S,5S)-3,5-dimethyl-1-[(4-pentoxy-1-naphthalenyl)sulfonyl]piperidine IUPAC Name: (3S,5S)-3,5-dimethyl-1-(4-pentoxynaphthalen-1-yl)sulfonylpiperidine Traditional Name: (3S,5S)-1-[(4-amoxy-1-naphthyl)sulfonyl]-3,5-dimethyl-piperidine Formula: C22H31NO3S MolecularWeight: 389.55144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3C[C@H](C[C@@H](C3)C)C

InChI

InChI=1S/C22H31NO3S/c1-4-5-8-13-26-21-11-12-22(20-10-7-6-9-19(20)21)27(24,25)23-15-17(2)14-18(3)16-23/h6-7,9-12,17-18H,4-5,8,13-16H2,1-3H3/t17-,18-/m0/s1