2-[2-[(5-bromanylnaphthalen-2-yl)methyl]-3-oxidanylidene-cyclohexen-1-yl]ethanoylcarbamic acid

Systemtic Name: 2-[2-[(5-bromanylnaphthalen-2-yl)methyl]-3-oxidanylidene-cyclohexen-1-yl]ethanoylcarbamic acid Openeye Name: [2-[2-[(5-bromo-2-naphthyl)methyl]-3-oxo-cyclohexen-1-yl]acetyl]carbamic acid CAS Name: [2-[2-[(5-bromo-2-naphthalenyl)methyl]-3-oxo-1-cyclohexenyl]-1-oxoethyl]carbamic acid IUPAC Name: [2-[2-[(5-bromonaphthalen-2-yl)methyl]-3-oxocyclohexen-1-yl]acetyl]carbamic acid Traditional Name: [2-[2-[(5-bromo-2-naphthyl)methyl]-3-keto-cyclohexen-1-yl]acetyl]carbamic acid Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO4/c21-17-5-1-3-13-9-12(7-8-15(13)17)10-16-14(4-2-6-18(16)23)11-19(24)22-20(25)26/h1,3,5,7-9H,2,4,6,10-11H2,(H,22,24)(H,25,26)