(3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-(2-naphthylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-(2-naphthalenylsulfonyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-naphthalen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-1-(2-naphthylsulfonyl)-N-piperonyl-nipecotamide Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H24N2O5S/c27-24(25-14-17-7-10-22-23(12-17)31-16-30-22)20-6-3-11-26(15-20)32(28,29)21-9-8-18-4-1-2-5-19(18)13-21/h1-2,4-5,7-10,12-13,20H,3,6,11,14-16H2,(H,25,27)/t20-/m0/s1