5-chloranyl-1-[3-(dimethylamino)propyl]-3-phenyl-benzimidazol-2-one hydrate hydrochloride

Systemtic Name: 5-chloranyl-1-[3-(dimethylamino)propyl]-3-phenyl-benzimidazol-2-one hydrate hydrochloride Openeye Name: 5-chloro-1-[3-(dimethylamino)propyl]-3-phenyl-benzimidazol-2-one hydrate hydrochloride CAS Name: 5-chloro-1-[3-(dimethylamino)propyl]-3-phenyl-2-benzimidazolone hydrate hydrochloride IUPAC Name: 5-chloro-1-[3-(dimethylamino)propyl]-3-phenylbenzimidazol-2-one hydrate hydrochloride Traditional Name: 5-chloro-1-[3-(dimethylamino)propyl]-3-phenyl-benzimidazol-2-one hydrate hydrochloride Formula: C18H23Cl2N3O2 MolecularWeight: 384.30012

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3.O.Cl

Isomeric SMILES

CN(C)CCCN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3.O.Cl

InChI

InChI=1S/C18H20ClN3O.ClH.H2O/c1-20(2)11-6-12-21-16-10-9-14(19)13-17(16)22(18(21)23)15-7-4-3-5-8-15;;/h3-5,7-10,13H,6,11-12H2,1-2H3;1H;1H2