(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)-1,2,3,4-tetrazol-5-yl]propyl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: (6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)-1,2,3,4-tetrazol-5-yl]propyl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: (6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: (6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)-5-tetrazolyl]propyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: (6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: (2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]-p-anisyl-ammonium Formula: C27H35N6O5+ MolecularWeight: 523.604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1CCOC)[NH+](CC2=CC=C(C=C2)OC)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

Isomeric SMILES

CC[C@@H](C1=NN=NN1CCOC)[NH+](CC2=CC=C(C=C2)OC)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

InChI

InChI=1S/C27H34N6O5/c1-6-23(26-29-30-31-33(26)11-12-35-2)32(16-18-7-9-21(36-3)10-8-18)17-20-13-19-14-24(37-4)25(38-5)15-22(19)28-27(20)34/h7-10,13-15,23H,6,11-12,16-17H2,1-5H3,(H,28,34)/p+1/t23-/m0/s1