N-(4-ethoxyphenyl)-2-[5-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[5-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[5-[4-(morpholin-4-ium-4-ylmethyl)phenyl]tetrazol-2-yl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[5-[4-(4-morpholin-4-iumylmethyl)phenyl]-2-tetrazolyl]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[5-[4-(morpholin-4-ium-4-ylmethyl)phenyl]tetrazol-2-yl]acetamide Traditional Name: 2-[5-[4-(morpholin-4-ium-4-ylmethyl)phenyl]tetrazol-2-yl]-N-p-phenetyl-acetamide Formula: C22H27N6O3+ MolecularWeight: 423.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C22H26N6O3/c1-2-31-20-9-7-19(8-10-20)23-21(29)16-28-25-22(24-26-28)18-5-3-17(4-6-18)15-27-11-13-30-14-12-27/h3-10H,2,11-16H2,1H3,(H,23,29)/p+1