butyl 4-[[3,5-bis(iodanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]benzoate

Systemtic Name: butyl 4-[[3,5-bis(iodanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]benzoate Openeye Name: butyl 4-[(3,5-diiodo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate CAS Name: 4-[(3,5-diiodo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3,5-diiodo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Traditional Name: 4-[(3,5-diiodo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid butyl ester Formula: C18H17I2NO3 MolecularWeight: 549.14142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)I)I

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)I)I

InChI

InChI=1S/C18H17I2NO3/c1-2-3-8-24-18(23)12-4-6-15(7-5-12)21-11-13-9-14(19)10-16(20)17(13)22/h4-7,9-11,21H,2-3,8H2,1H3