2-[2-iodanyl-4-[(E)-[(4-pyridin-3-ylphenyl)hydrazinylidene]methyl]phenyl]ethylcarbamic acid

Systemtic Name: 2-[2-iodanyl-4-[(E)-[(4-pyridin-3-ylphenyl)hydrazinylidene]methyl]phenyl]ethylcarbamic acid Openeye Name: 2-[2-iodo-4-[(E)-[[4-(3-pyridyl)phenyl]hydrazono]methyl]phenyl]ethylcarbamic acid CAS Name: 2-[2-iodo-4-[(E)-[[4-(3-pyridinyl)phenyl]hydrazinylidene]methyl]phenyl]ethylcarbamic acid IUPAC Name: 2-[2-iodo-4-[(E)-[(4-pyridin-3-ylphenyl)hydrazinylidene]methyl]phenyl]ethylcarbamic acid Traditional Name: 2-[2-iodo-4-[(E)-[[4-(3-pyridyl)phenyl]hydrazono]methyl]phenyl]ethylcarbamic acid Formula: C21H19IN4O2 MolecularWeight: 486.30563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=CC=C(C=C2)NN=CC3=CC(=C(C=C3)CCNC(=O)O)I

Isomeric SMILES

C1=CC(=CN=C1)C2=CC=C(C=C2)N/N=C/C3=CC(=C(C=C3)CCNC(=O)O)I

InChI

InChI=1S/C21H19IN4O2/c22-20-12-15(3-4-17(20)9-11-24-21(27)28)13-25-26-19-7-5-16(6-8-19)18-2-1-10-23-14-18/h1-8,10,12-14,24,26H,9,11H2,(H,27,28)/b25-13+