4-bromanyl-2-heptyl-3-[(phenylmethyl)amino]-2H-furan-5-one

Systemtic Name: 4-bromanyl-2-heptyl-3-[(phenylmethyl)amino]-2H-furan-5-one Openeye Name: 3-(benzylamino)-4-bromo-2-heptyl-2H-furan-5-one CAS Name: 4-bromo-2-heptyl-3-[(phenylmethyl)amino]-2H-furan-5-one IUPAC Name: 3-(benzylamino)-4-bromo-2-heptyl-2H-furan-5-one Traditional Name: 3-(benzylamino)-4-bromo-2-heptyl-2H-furan-5-one Formula: C18H24BrNO2 MolecularWeight: 366.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=C(C(=O)O1)Br)NCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1C(=C(C(=O)O1)Br)NCC2=CC=CC=C2

InChI

InChI=1S/C18H24BrNO2/c1-2-3-4-5-9-12-15-17(16(19)18(21)22-15)20-13-14-10-7-6-8-11-14/h6-8,10-11,15,20H,2-5,9,12-13H2,1H3