(3S)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidin-2-yl]carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidin-2-yl]carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carbonyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyrrolidinyl]-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carbonyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)prolyl]-N-phenyl-nipecotamide Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)[C@H]2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C25H29N3O6S/c29-24(26-19-7-2-1-3-8-19)18-6-4-12-27(17-18)25(30)21-9-5-13-28(21)35(31,32)20-10-11-22-23(16-20)34-15-14-33-22/h1-3,7-8,10-11,16,18,21H,4-6,9,12-15,17H2,(H,26,29)/t18-,21+/m0/s1