4-[(R)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-thiophen-2-yl-methyl]morpholin-4-ium

Systemtic Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-thiophen-2-yl-methyl]morpholin-4-ium Openeye Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-(2-thienyl)methyl]morpholin-4-ium CAS Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]-5-tetrazolyl]-thiophen-2-ylmethyl]morpholin-4-ium IUPAC Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-thiophen-2-ylmethyl]morpholin-4-ium Traditional Name: 4-[(R)-(1-p-anisyltetrazol-5-yl)-(2-thienyl)methyl]morpholin-4-ium Formula: C18H22N5O2S+ MolecularWeight: 372.46458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=NN=N2)C(C3=CC=CS3)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=NN=N2)[C@H](C3=CC=CS3)[NH+]4CCOCC4

InChI

InChI=1S/C18H21N5O2S/c1-24-15-6-4-14(5-7-15)13-23-18(19-20-21-23)17(16-3-2-12-26-16)22-8-10-25-11-9-22/h2-7,12,17H,8-11,13H2,1H3/p+1/t17-/m0/s1