aziridin-1-yl-[6-(4-bromophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate

Systemtic Name: aziridin-1-yl-[6-(4-bromophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate Openeye Name: aziridin-1-yl-[6-(4-bromophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate CAS Name: 1-aziridinyl-[6-(4-bromophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]methanolate IUPAC Name: aziridin-1-yl-[6-(4-bromophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate Traditional Name: (6-brosyliminocyclohexa-2,4-dien-1-ylidene)-ethylenimino-methanolate Formula: C15H12BrN2O3S- MolecularWeight: 380.23638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN1C(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

C1CN1C(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C15H13BrN2O3S/c16-11-5-7-12(8-6-11)22(20,21)17-14-4-2-1-3-13(14)15(19)18-9-10-18/h1-8,19H,9-10H2/p-1