(2E)-2-(7-acetyloxy-5-chloranyl-8,8a-dimethyl-3-oxidanylidene-7,8-dihydro-1H-naphthalen-2-ylidene)propanoic acid

Systemtic Name: (2E)-2-(7-acetyloxy-5-chloranyl-8,8a-dimethyl-3-oxidanylidene-7,8-dihydro-1H-naphthalen-2-ylidene)propanoic acid Openeye Name: (2E)-2-(7-acetoxy-5-chloro-8,8a-dimethyl-3-oxo-7,8-dihydro-1H-naphthalen-2-ylidene)propanoic acid CAS Name: (2E)-2-(7-acetyloxy-5-chloro-8,8a-dimethyl-3-oxo-7,8-dihydro-1H-naphthalen-2-ylidene)propanoic acid IUPAC Name: (2E)-2-(7-acetyloxy-5-chloro-8,8a-dimethyl-3-oxo-7,8-dihydro-1H-naphthalen-2-ylidene)propanoic acid Traditional Name: (2E)-2-(7-acetoxy-5-chloro-3-keto-8,8a-dimethyl-7,8-dihydro-1H-naphthalen-2-ylidene)propionic acid Formula: C17H19ClO5 MolecularWeight: 338.78276

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C=C(C2=CC(=O)C(=C(C)C(=O)O)CC12C)Cl)OC(=O)C

Isomeric SMILES

CC1C(C=C(C2=CC(=O)/C(=C(\C)/C(=O)O)/CC12C)Cl)OC(=O)C

InChI

InChI=1S/C17H19ClO5/c1-8(16(21)22)11-7-17(4)9(2)15(23-10(3)19)6-13(18)12(17)5-14(11)20/h5-6,9,15H,7H2,1-4H3,(H,21,22)/b11-8+