4-bromanyl-5-(bromomethyl)-3-butyl-5-[(phenylmethyl)amino]furan-2-one

Systemtic Name: 4-bromanyl-5-(bromomethyl)-3-butyl-5-[(phenylmethyl)amino]furan-2-one Openeye Name: 5-(benzylamino)-4-bromo-5-(bromomethyl)-3-butyl-furan-2-one CAS Name: 4-bromo-5-(bromomethyl)-3-butyl-5-[(phenylmethyl)amino]-2-furanone IUPAC Name: 5-(benzylamino)-4-bromo-5-(bromomethyl)-3-butylfuran-2-one Traditional Name: 5-(benzylamino)-4-bromo-5-(bromomethyl)-3-butyl-furan-2-one Formula: C16H19Br2NO2 MolecularWeight: 417.13556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(OC1=O)(CBr)NCC2=CC=CC=C2)Br

Isomeric SMILES

CCCCC1=C(C(OC1=O)(CBr)NCC2=CC=CC=C2)Br

InChI

InChI=1S/C16H19Br2NO2/c1-2-3-9-13-14(18)16(11-17,21-15(13)20)19-10-12-7-5-4-6-8-12/h4-8,19H,2-3,9-11H2,1H3