(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: (1-butyltetrazol-5-yl)methyl 3-methoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-3-methoxy-benzoic acid (1-butyltetrazol-5-yl)methyl ester Formula: C20H27N5O6 MolecularWeight: 433.45828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)OC

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)OC

InChI

InChI=1S/C20H27N5O6/c1-3-4-7-25-18(21-22-23-25)13-31-20(27)15-5-6-16(17(12-15)28-2)30-14-19(26)24-8-10-29-11-9-24/h5-6,12H,3-4,7-11,13-14H2,1-2H3