cyclopentyl-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]azanium

Systemtic Name: cyclopentyl-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]azanium Openeye Name: cyclopentyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-[(1-phenethyltetrazol-5-yl)methyl]ammonium CAS Name: cyclopentyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-[(1-phenethyl-5-tetrazolyl)methyl]ammonium IUPAC Name: cyclopentyl-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-[(1-phenethyltetrazol-5-yl)methyl]azanium Traditional Name: cyclopentyl-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-[(1-phenethyltetrazol-5-yl)methyl]ammonium Formula: C27H33N6O2+ MolecularWeight: 473.58992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C[NH+](CC3=NN=NN3CCC4=CC=CC=C4)C5CCCC5

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C[NH+](CC3=NN=NN3CCC4=CC=CC=C4)C5CCCC5

InChI

InChI=1S/C27H32N6O2/c1-2-35-24-12-13-25-21(17-24)16-22(27(34)28-25)18-32(23-10-6-7-11-23)19-26-29-30-31-33(26)15-14-20-8-4-3-5-9-20/h3-5,8-9,12-13,16-17,23H,2,6-7,10-11,14-15,18-19H2,1H3,(H,28,34)/p+1