(4-chloranyl-2-methyl-phenyl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: (4-chloro-2-methyl-phenyl) 2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetate CAS Name: 2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid (4-chloro-2-methyl-phenyl) ester Formula: C14H11ClN4O3S MolecularWeight: 350.78014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C14H11ClN4O3S/c1-9-7-10(15)4-5-11(9)22-13(20)8-18-14(21)19(17-16-18)12-3-2-6-23-12/h2-7H,8H2,1H3