2-methyl-3-[(2-methylimidazol-1-yl)methyl]-9-oxidanidyl-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride

Systemtic Name: 2-methyl-3-[(2-methylimidazol-1-yl)methyl]-9-oxidanidyl-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride Openeye Name: 2-methyl-3-[(2-methylimidazol-1-yl)methyl]-9-oxido-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride CAS Name: 2-methyl-3-[(2-methyl-1-imidazolyl)methyl]-9-oxido-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride IUPAC Name: 2-methyl-3-[(2-methylimidazol-1-yl)methyl]-9-oxido-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride Traditional Name: 2-methyl-3-[(2-methylimidazol-1-yl)methyl]-9-oxido-2,3,4,5-tetrahydro-1H-carbazol-9-ium dihydrate hydrochloride Formula: C18H26ClN3O3 MolecularWeight: 367.87034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=[N+](C3=CC=CCC3=C2CC1CN4C=CN=C4C)[O-].O.O.Cl

Isomeric SMILES

CC1CC2=[N+](C3=CC=CCC3=C2CC1CN4C=CN=C4C)[O-].O.O.Cl

InChI

InChI=1S/C18H21N3O.ClH.2H2O/c1-12-9-18-16(15-5-3-4-6-17(15)21(18)22)10-14(12)11-20-8-7-19-13(20)2;;;/h3-4,6-8,12,14H,5,9-11H2,1-2H3;1H;2*1H2