ethanoic acid; 4-[(Z)-indol-3-ylidenemethyl]-5-methyl-3-oxidanylidene-1H-pyrazole-2-carboximidamide

Systemtic Name: ethanoic acid; 4-[(Z)-indol-3-ylidenemethyl]-5-methyl-3-oxidanylidene-1H-pyrazole-2-carboximidamide Openeye Name: acetic acid; 4-[(Z)-indol-3-ylidenemethyl]-5-methyl-3-oxo-1H-pyrazole-2-carboxamidine CAS Name: acetic acid; 4-[(Z)-3-indolylidenemethyl]-5-methyl-3-oxo-1H-pyrazole-2-carboximidamide IUPAC Name: acetic acid; 4-[(Z)-indol-3-ylidenemethyl]-5-methyl-3-oxo-1H-pyrazole-2-carboximidamide Traditional Name: acetic acid; 4-[(Z)-indol-3-ylidenemethyl]-5-keto-3-methyl-3-pyrazoline-1-carboxamidine Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(=N)N)C=C2C=NC3=CC=CC=C32.CC(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C(=N)N)/C=C/2\C=NC3=CC=CC=C32.CC(=O)O

InChI

InChI=1S/C14H13N5O.C2H4O2/c1-8-11(13(20)19(18-8)14(15)16)6-9-7-17-12-5-3-2-4-10(9)12;1-2(3)4/h2-7,18H,1H3,(H3,15,16);1H3,(H,3,4)/b9-6+;