2-[5-(azepan-1-ylsulfonyl)-2,3-dihydroindol-1-yl]ethylazanium

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)-2,3-dihydroindol-1-yl]ethylazanium Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indolin-1-yl]ethylammonium CAS Name: 2-[5-(1-azepanylsulfonyl)-2,3-dihydroindol-1-yl]ethylammonium IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2,3-dihydroindol-1-yl]ethylazanium Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indolin-1-yl]ethylammonium Formula: C16H26N3O2S+ MolecularWeight: 324.46154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)CC[NH3+]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)CC[NH3+]

InChI

InChI=1S/C16H25N3O2S/c17-8-12-18-11-7-14-13-15(5-6-16(14)18)22(20,21)19-9-3-1-2-4-10-19/h5-6,13H,1-4,7-12,17H2/p+1