3-[(2-aminophenyl)amino]-2-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]but-3-enenitrile

Systemtic Name: 3-[(2-aminophenyl)amino]-2-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]but-3-enenitrile Openeye Name: 3-(2-aminoanilino)-2-[(3-ethoxy-4-hydroxy-5-iodo-phenyl)methylene]but-3-enenitrile CAS Name: 3-(2-aminoanilino)-2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-butenenitrile IUPAC Name: 3-(2-aminoanilino)-2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]but-3-enenitrile Traditional Name: 3-(2-aminoanilino)-2-(3-ethoxy-4-hydroxy-5-iodo-benzylidene)but-3-enenitrile Formula: C19H18IN3O2 MolecularWeight: 447.26959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=C)NC2=CC=CC=C2N)I)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=C)NC2=CC=CC=C2N)I)O

InChI

InChI=1S/C19H18IN3O2/c1-3-25-18-10-13(9-15(20)19(18)24)8-14(11-21)12(2)23-17-7-5-4-6-16(17)22/h4-10,23-24H,2-3,22H2,1H3