3-(cyclooctylmethyl)-1-ethyl-2-oxidanylidene-7-piperidin-4-yl-1-(sulfamoylamino)benzimidazol-1-ium

Systemtic Name: 3-(cyclooctylmethyl)-1-ethyl-2-oxidanylidene-7-piperidin-4-yl-1-(sulfamoylamino)benzimidazol-1-ium Openeye Name: 3-(cyclooctylmethyl)-1-ethyl-2-oxo-7-(4-piperidyl)-1-(sulfamoylamino)benzimidazol-1-ium CAS Name: 3-(cyclooctylmethyl)-1-ethyl-2-oxo-7-(4-piperidinyl)-1-(sulfamoylamino)benzimidazol-1-ium IUPAC Name: 3-(cyclooctylmethyl)-1-ethyl-2-oxo-7-piperidin-4-yl-1-(sulfamoylamino)benzimidazol-1-ium Traditional Name: 3-(cyclooctylmethyl)-1-ethyl-2-keto-7-(4-piperidyl)-1-(sulfamoylamino)benzimidazol-1-ium Formula: C23H38N5O3S+ MolecularWeight: 464.64452

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C2=C(C=CC=C2N(C1=O)CC3CCCCCCC3)C4CCNCC4)NS(=O)(=O)N

Isomeric SMILES

CC[N+]1(C2=C(C=CC=C2N(C1=O)CC3CCCCCCC3)C4CCNCC4)NS(=O)(=O)N

InChI

InChI=1S/C23H38N5O3S/c1-2-28(26-32(24,30)31)22-20(19-13-15-25-16-14-19)11-8-12-21(22)27(23(28)29)17-18-9-6-4-3-5-7-10-18/h8,11-12,18-19,25-26H,2-7,9-10,13-17H2,1H3,(H2,24,30,31)/q+1