3-(imidazol-1-ylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride

Systemtic Name: 3-(imidazol-1-ylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride Openeye Name: 3-(imidazol-1-ylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride CAS Name: 3-(1-imidazolylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride IUPAC Name: 3-(imidazol-1-ylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride Traditional Name: 3-(imidazol-1-ylmethyl)-9-methyl-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride Formula: C17H22ClN3O3 MolecularWeight: 351.82788

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN4C=CN=C4.O.O.Cl

Isomeric SMILES

CN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN4C=CN=C4.O.O.Cl

InChI

InChI=1S/C17H17N3O.ClH.2H2O/c1-19-14-5-3-2-4-13(14)16-15(19)7-6-12(17(16)21)10-20-9-8-18-11-20;;;/h2-5,8-9,11-12H,6-7,10H2,1H3;1H;2*1H2