3-[[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[3-(1-cyclopropyltetrazol-5-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[3-(1-cyclopropyl-5-tetrazolyl)phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[3-(1-cyclopropyltetrazol-5-yl)phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[[3-(1-cyclopropyltetrazol-5-yl)phenyl]sulfamoyl]-4-methoxy-benzoic acid Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

InChI

InChI=1S/C18H17N5O5S/c1-28-15-8-5-12(18(24)25)10-16(15)29(26,27)20-13-4-2-3-11(9-13)17-19-21-22-23(17)14-6-7-14/h2-5,8-10,14,20H,6-7H2,1H3,(H,24,25)