N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]naphthalene-2-sulfonamide CAS Name: N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide Traditional Name: N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]naphthalene-2-sulfonamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C26H28N2O5S/c29-26(12-13-27-34(30,31)22-10-8-19-5-1-2-6-20(19)17-22)28-14-3-7-23(28)21-9-11-24-25(18-21)33-16-4-15-32-24/h1-2,5-6,8-11,17-18,23,27H,3-4,7,12-16H2/t23-/m0/s1