1,3-benzodioxol-5-ylmethyl-[1-(4,6-dimethylquinazolin-2-yl)piperidin-4-yl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[1-(4,6-dimethylquinazolin-2-yl)piperidin-4-yl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[1-(4,6-dimethylquinazolin-2-yl)-4-piperidyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[1-(4,6-dimethyl-2-quinazolinyl)-4-piperidinyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[1-(4,6-dimethylquinazolin-2-yl)piperidin-4-yl]azanium Traditional Name: [1-(4,6-dimethylquinazolin-2-yl)-4-piperidyl]-piperonyl-ammonium Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C)N3CCC(CC3)[NH2+]CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C)N3CCC(CC3)[NH2+]CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N4O2/c1-15-3-5-20-19(11-15)16(2)25-23(26-20)27-9-7-18(8-10-27)24-13-17-4-6-21-22(12-17)29-14-28-21/h3-6,11-12,18,24H,7-10,13-14H2,1-2H3/p+1