4,6,7-trimethyl-2-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]quinazoline

Systemtic Name: 4,6,7-trimethyl-2-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]quinazoline Openeye Name: 4,6,7-trimethyl-2-[4-[4-(3-pyridyloxy)piperidin-1-ium-1-yl]-1-piperidyl]quinazoline CAS Name: 4,6,7-trimethyl-2-[4-[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]-1-piperidinyl]quinazoline IUPAC Name: 4,6,7-trimethyl-2-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]quinazoline Traditional Name: 4,6,7-trimethyl-2-[4-[4-(3-pyridyloxy)piperidin-1-ium-1-yl]piperidino]quinazoline Formula: C26H34N5O+ MolecularWeight: 432.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)[NH+]4CCC(CC4)OC5=CN=CC=C5)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)[NH+]4CCC(CC4)OC5=CN=CC=C5)C)C

InChI

InChI=1S/C26H33N5O/c1-18-15-24-20(3)28-26(29-25(24)16-19(18)2)31-11-6-21(7-12-31)30-13-8-22(9-14-30)32-23-5-4-10-27-17-23/h4-5,10,15-17,21-22H,6-9,11-14H2,1-3H3/p+1