2,1,3-benzoxadiazol-5-ylmethyl-[1-(6-ethoxy-4-methyl-quinazolin-2-yl)piperidin-4-yl]azanium

Systemtic Name: 2,1,3-benzoxadiazol-5-ylmethyl-[1-(6-ethoxy-4-methyl-quinazolin-2-yl)piperidin-4-yl]azanium Openeye Name: 2,1,3-benzoxadiazol-5-ylmethyl-[1-(6-ethoxy-4-methyl-quinazolin-2-yl)-4-piperidyl]ammonium CAS Name: 2,1,3-benzoxadiazol-5-ylmethyl-[1-(6-ethoxy-4-methyl-2-quinazolinyl)-4-piperidinyl]ammonium IUPAC Name: 2,1,3-benzoxadiazol-5-ylmethyl-[1-(6-ethoxy-4-methylquinazolin-2-yl)piperidin-4-yl]azanium Traditional Name: benzofurazan-5-ylmethyl-[1-(6-ethoxy-4-methyl-quinazolin-2-yl)-4-piperidyl]ammonium Formula: C23H27N6O2+ MolecularWeight: 419.49948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCC(CC3)[NH2+]CC4=CC5=NON=C5C=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCC(CC3)[NH2+]CC4=CC5=NON=C5C=C4

InChI

InChI=1S/C23H26N6O2/c1-3-30-18-5-7-20-19(13-18)15(2)25-23(26-20)29-10-8-17(9-11-29)24-14-16-4-6-21-22(12-16)28-31-27-21/h4-7,12-13,17,24H,3,8-11,14H2,1-2H3/p+1