(4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carboximidamide; ethanoic acid

Systemtic Name: (4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carboximidamide; ethanoic acid Openeye Name: acetic acid; (4Z)-4-[(4-dimethylaminophenyl)methylene]-3-methyl-5-oxo-pyrazole-1-carboxamidine CAS Name: acetic acid; (4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methyl-5-oxo-1-pyrazolecarboximidamide IUPAC Name: acetic acid; (4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methyl-5-oxopyrazole-1-carboximidamide Traditional Name: acetic acid; (4Z)-4-[4-(dimethylamino)benzylidene]-5-keto-3-methyl-2-pyrazoline-1-carboxamidine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C(=N)N.CC(=O)O

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N(C)C)C(=N)N.CC(=O)O

InChI

InChI=1S/C14H17N5O.C2H4O2/c1-9-12(13(20)19(17-9)14(15)16)8-10-4-6-11(7-5-10)18(2)3;1-2(3)4/h4-8H,1-3H3,(H3,15,16);1H3,(H,3,4)/b12-8-;