4-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[[2-(3-iodophenyl)-1,3-benzoxazol-6-yl]amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[[2-(3-iodophenyl)-1,3-benzoxazol-6-yl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[[2-(3-iodophenyl)-1,3-benzoxazol-6-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[[2-(3-iodophenyl)-1,3-benzoxazol-6-yl]amino]methylene]cyclohexa-2,5-dien-1-one Formula: C20H13IN2O2 MolecularWeight: 440.23389

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=C(C=C3)NC=C4C=CC(=O)C=C4

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=C(C=C3)NC=C4C=CC(=O)C=C4

InChI

InChI=1S/C20H13IN2O2/c21-15-3-1-2-14(10-15)20-23-18-9-6-16(11-19(18)25-20)22-12-13-4-7-17(24)8-5-13/h1-12,22H