13-[(3R)-3-(benzotriazol-1-yl)-3-ethoxy-propyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane

Systemtic Name: 13-[(3R)-3-(benzotriazol-1-yl)-3-ethoxy-propyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane Openeye Name: 13-[(3R)-3-(benzotriazol-1-yl)-3-ethoxy-propyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane CAS Name: 13-[(3R)-3-(1-benzotriazolyl)-3-ethoxypropyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane IUPAC Name: 13-[(3R)-3-(benzotriazol-1-yl)-3-ethoxypropyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane Traditional Name: 13-[(3R)-3-(benzotriazol-1-yl)-3-ethoxy-propyl]-1,4,7,10-tetraoxa-13-azoniacyclopentadecane Formula: C21H35N4O5+ MolecularWeight: 423.5264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC[NH+]1CCOCCOCCOCCOCC1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCO[C@H](CC[NH+]1CCOCCOCCOCCOCC1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C21H34N4O5/c1-2-30-21(25-20-6-4-3-5-19(20)22-23-25)7-8-24-9-11-26-13-15-28-17-18-29-16-14-27-12-10-24/h3-6,21H,2,7-18H2,1H3/p+1/t21-/m1/s1