[5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]azanium

Systemtic Name: [5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]azanium Openeye Name: [5-(6-methoxy-2-naphthyl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]ammonium CAS Name: [5-(6-methoxy-2-naphthalenyl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]ammonium IUPAC Name: [5-(6-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]azanium Traditional Name: [5-(6-methoxy-2-naphthyl)-1H-pyrazol-4-yl]methyl-[(1S)-2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]ammonium Formula: C27H30N5O+ MolecularWeight: 440.56

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(C(C)C)[NH2+]CC3=C(NN=C3)C4=CC5=C(C=C4)C=C(C=C5)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)[C@H](C(C)C)[NH2+]CC3=C(NN=C3)C4=CC5=C(C=C4)C=C(C=C5)OC

InChI

InChI=1S/C27H29N5O/c1-16(2)25(27-30-23-10-5-17(3)11-24(23)31-27)28-14-21-15-29-32-26(21)20-7-6-19-13-22(33-4)9-8-18(19)12-20/h5-13,15-16,25,28H,14H2,1-4H3,(H,29,32)(H,30,31)/p+1/t25-/m0/s1