2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxidanidyl-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine

Systemtic Name: 2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxidanidyl-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine Openeye Name: 2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxido-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine CAS Name: 2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxido-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine IUPAC Name: 2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxido-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine Traditional Name: 2-[(E)-[7-(2-chlorophenyl)-4-methyl-1-oxido-7,8-dihydro-6H-cinnolin-1-ium-5-ylidene]amino]guanidine Formula: C16H17ClN6O MolecularWeight: 344.79878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=[N+](C2=C1C(=NN=C(N)N)CC(C2)C3=CC=CC=C3Cl)[O-]

Isomeric SMILES

CC1=CN=[N+](C2=C1/C(=N/N=C(N)N)/CC(C2)C3=CC=CC=C3Cl)[O-]

InChI

InChI=1S/C16H17ClN6O/c1-9-8-20-23(24)14-7-10(11-4-2-3-5-12(11)17)6-13(15(9)14)21-22-16(18)19/h2-5,8,10H,6-7H2,1H3,(H4,18,19,22)/b21-13+