(2E)-1-[4-chloranyl-3-[(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]-2-methylsulfonyl-phenyl]-3-cyclopropyl-2-(ethoxymethylidene)propane-1,3-dione

Systemtic Name: (2E)-1-[4-chloranyl-3-[(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]-2-methylsulfonyl-phenyl]-3-cyclopropyl-2-(ethoxymethylidene)propane-1,3-dione Openeye Name: (2E)-1-[4-chloro-3-[(4-methyl-5-oxo-tetrazol-1-yl)methyl]-2-methylsulfonyl-phenyl]-3-cyclopropyl-2-(ethoxymethylene)propane-1,3-dione CAS Name: (2E)-1-[4-chloro-3-[(4-methyl-5-oxo-1-tetrazolyl)methyl]-2-methylsulfonylphenyl]-3-cyclopropyl-2-(ethoxymethylidene)propane-1,3-dione IUPAC Name: (2E)-1-[4-chloro-3-[(4-methyl-5-oxotetrazol-1-yl)methyl]-2-methylsulfonylphenyl]-3-cyclopropyl-2-(ethoxymethylidene)propane-1,3-dione Traditional Name: (2E)-1-[4-chloro-3-[(5-keto-4-methyl-tetrazol-1-yl)methyl]-2-mesyl-phenyl]-3-cyclopropyl-2-(ethoxymethylene)propane-1,3-dione Formula: C19H21ClN4O6S MolecularWeight: 468.91124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C(=O)C1CC1)C(=O)C2=C(C(=C(C=C2)Cl)CN3C(=O)N(N=N3)C)S(=O)(=O)C

Isomeric SMILES

CCO/C=C(\C(=O)C1CC1)/C(=O)C2=C(C(=C(C=C2)Cl)CN3C(=O)N(N=N3)C)S(=O)(=O)C

InChI

InChI=1S/C19H21ClN4O6S/c1-4-30-10-14(16(25)11-5-6-11)17(26)12-7-8-15(20)13(18(12)31(3,28)29)9-24-19(27)23(2)21-22-24/h7-8,10-11H,4-6,9H2,1-3H3/b14-10+