4-butyl-1-ethyl-7-oxidanyl-1-(propylamino)-3H-indol-1-ium-2-one hydrochloride

Systemtic Name: 4-butyl-1-ethyl-7-oxidanyl-1-(propylamino)-3H-indol-1-ium-2-one hydrochloride Openeye Name: 4-butyl-1-ethyl-7-hydroxy-1-(propylamino)indolin-1-ium-2-one hydrochloride CAS Name: 4-butyl-1-ethyl-7-hydroxy-1-(propylamino)-3H-indol-1-ium-2-one hydrochloride IUPAC Name: 4-butyl-1-ethyl-7-hydroxy-1-(propylamino)-3H-indol-1-ium-2-one hydrochloride Traditional Name: 4-butyl-1-ethyl-7-hydroxy-1-(propylamino)indolin-1-ium-2-one hydrochloride Formula: C17H28ClN2O2+ MolecularWeight: 327.86942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2CC(=O)[N+](C2=C(C=C1)O)(CC)NCCC.Cl

Isomeric SMILES

CCCCC1=C2CC(=O)[N+](C2=C(C=C1)O)(CC)NCCC.Cl

InChI

InChI=1S/C17H26N2O2.ClH/c1-4-7-8-13-9-10-15(20)17-14(13)12-16(21)19(17,6-3)18-11-5-2;/h9-10,18H,4-8,11-12H2,1-3H3;1H/p+1