[(1R)-3-(benzotriazol-1-yl)-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]-(2-methylpropyl)azanium

Systemtic Name: [(1R)-3-(benzotriazol-1-yl)-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]-(2-methylpropyl)azanium Openeye Name: [(1R)-3-(benzotriazol-1-yl)-1-(4-methoxyphenyl)-3-oxo-propyl]-isobutyl-ammonium CAS Name: [(1R)-3-(1-benzotriazolyl)-1-(4-methoxyphenyl)-3-oxopropyl]-(2-methylpropyl)ammonium IUPAC Name: [(1R)-3-(benzotriazol-1-yl)-1-(4-methoxyphenyl)-3-oxopropyl]-(2-methylpropyl)azanium Traditional Name: [(1R)-3-(benzotriazol-1-yl)-3-keto-1-(4-methoxyphenyl)propyl]-isobutyl-ammonium Formula: C20H25N4O2+ MolecularWeight: 353.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]C(CC(=O)N1C2=CC=CC=C2N=N1)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C[NH2+][C@H](CC(=O)N1C2=CC=CC=C2N=N1)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H24N4O2/c1-14(2)13-21-18(15-8-10-16(26-3)11-9-15)12-20(25)24-19-7-5-4-6-17(19)22-23-24/h4-11,14,18,21H,12-13H2,1-3H3/p+1/t18-/m1/s1