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

Systemtic Name: 2-[4-[4-(2-methoxyphenoxy)piperidin-1-ium-1-yl]piperidin-1-yl]-4,6,7-trimethyl-quinazoline Openeye Name: 2-[4-[4-(2-methoxyphenoxy)piperidin-1-ium-1-yl]-1-piperidyl]-4,6,7-trimethyl-quinazoline CAS Name: 2-[4-[4-(2-methoxyphenoxy)-1-piperidin-1-iumyl]-1-piperidinyl]-4,6,7-trimethylquinazoline IUPAC Name: 2-[4-[4-(2-methoxyphenoxy)piperidin-1-ium-1-yl]piperidin-1-yl]-4,6,7-trimethylquinazoline Traditional Name: 2-[4-[4-(2-methoxyphenoxy)piperidin-1-ium-1-yl]piperidino]-4,6,7-trimethyl-quinazoline Formula: C28H37N4O2+ MolecularWeight: 461.61898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)[NH+]4CCC(CC4)OC5=CC=CC=C5OC)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)[NH+]4CCC(CC4)OC5=CC=CC=C5OC)C)C

InChI

InChI=1S/C28H36N4O2/c1-19-17-24-21(3)29-28(30-25(24)18-20(19)2)32-13-9-22(10-14-32)31-15-11-23(12-16-31)34-27-8-6-5-7-26(27)33-4/h5-8,17-18,22-23H,9-16H2,1-4H3/p+1