[3-(5-bromanylnaphthalen-2-yl)-2-(3-oxidanylidenecyclohexen-1-yl)propanoyl]carbamic acid

Systemtic Name: [3-(5-bromanylnaphthalen-2-yl)-2-(3-oxidanylidenecyclohexen-1-yl)propanoyl]carbamic acid Openeye Name: [3-(5-bromo-2-naphthyl)-2-(3-oxocyclohexen-1-yl)propanoyl]carbamic acid CAS Name: [3-(5-bromo-2-naphthalenyl)-1-oxo-2-(3-oxo-1-cyclohexenyl)propyl]carbamic acid IUPAC Name: [3-(5-bromonaphthalen-2-yl)-2-(3-oxocyclohexen-1-yl)propanoyl]carbamic acid Traditional Name: [3-(5-bromo-2-naphthyl)-2-(3-ketocyclohexen-1-yl)propanoyl]carbamic acid Formula: C20H18BrNO4 MolecularWeight: 416.26522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)C(CC2=CC3=C(C=C2)C(=CC=C3)Br)C(=O)NC(=O)O

Isomeric SMILES

C1CC(=CC(=O)C1)C(CC2=CC3=C(C=C2)C(=CC=C3)Br)C(=O)NC(=O)O

InChI

InChI=1S/C20H18BrNO4/c21-18-6-2-4-13-9-12(7-8-16(13)18)10-17(19(24)22-20(25)26)14-3-1-5-15(23)11-14/h2,4,6-9,11,17H,1,3,5,10H2,(H,22,24)(H,25,26)