1,3-dimethyl-5-[(prop-2-enylamino)methyl]benzimidazol-2-one hydrochloride

Systemtic Name: 1,3-dimethyl-5-[(prop-2-enylamino)methyl]benzimidazol-2-one hydrochloride Openeye Name: 5-[(allylamino)methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride CAS Name: 1,3-dimethyl-5-[(prop-2-enylamino)methyl]-2-benzimidazolone hydrochloride IUPAC Name: 1,3-dimethyl-5-[(prop-2-enylamino)methyl]benzimidazol-2-one hydrochloride Traditional Name: 5-[(allylamino)methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride Formula: C13H18ClN3O MolecularWeight: 267.75452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CNCC=C)N(C1=O)C.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)CNCC=C)N(C1=O)C.Cl

InChI

InChI=1S/C13H17N3O.ClH/c1-4-7-14-9-10-5-6-11-12(8-10)16(3)13(17)15(11)2;/h4-6,8,14H,1,7,9H2,2-3H3;1H